A0A087XKK0_POEFO Loading...

Grainyhead-like transcription factor 2b

AlphaFold DB , UniProt , Accession A0A087XKK0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 605 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	33.9	Very low	238 Å²	238	164.3 Å²	164.3	100%	1.172	83%	0.828	S	S	*	*				0	142.5	0	-55.6	-163.7	-155.4	0	0	107.6
2	S	34.7	Very low	33.9	Very low	105 Å²	105	161.3 Å²	161.3	73%	0.734	82%	0.824	S	S	*	*			cis	-173.8	138.1	-25.5	-82.9	0	0	0	0	104.2
3	Q	32.8	Very low	33.8	Very low	155 Å²	155	158.5 Å²	158.5	72%	0.724	82%	0.819	S	S	*	*			trans	42.4	130	141.2	-82.3	-178.9	-32.3	0	0	123.4
4	E	34.3	Very low	33.6	Very low	152 Å²	152	156.6 Å²	156.6	71%	0.71	82%	0.817	S	S	*	*				64.2	147.3	122.6	-66.5	178	151.9	0	0	119
5	T	39.1	Very low	33.5	Very low	107 Å²	107	153.8 Å²	153.8	66%	0.656	81%	0.813	S	S	*	*			cis	-171.9	152.6	3.3	23	0	0	0	0	105.2
6	D	30.4	Very low	33.4	Very low	172 Å²	172	152.9 Å²	152.9	92%	0.92	81%	0.808	S	S	*	*			trans	-137.5	135.4	159.7	-118.3	-27.4	0	0	0	111.7
7	N	36	Very low	33.2	Very low	138 Å²	138	154.5 Å²	154.5	74%	0.738	81%	0.811	S	S	*	*			trans	-118	123.6	-171.9	-103.5	-47.3	0	0	0	109.1
8	K	35.2	Very low	33.1	Very low	200 Å²	200	151.4 Å²	151.4	87%	0.87	80%	0.804	S	S	*	*				157	124.6	126.1	-84.2	160.4	-174	176.3	0	114.4
9	R	33.3	Very low	33	Very low	238 Å²	238	149.4 Å²	149.4	90%	0.898	80%	0.803	S	S	*	*			trans	52.3	124.2	145.3	-90	-173.4	176.2	-160.7	-0.8	121.4
10	L	30.7	Very low	33	Very low	172 Å²	172	151.9 Å²	151.9	90%	0.901	81%	0.807	S	S	*	*				-159.2	141.9	128.5	-108.9	140	0	0	0	111.6
11	V	35.4	Very low	33.3	Very low	130 Å²	130	150.8 Å²	150.8	79%	0.788	81%	0.808	S	S	*	*			trans	-86.2	134.4	179.3	169.8	0	0	0	0	109.3
12	V	33.3	Very low	33.5	Very low	128 Å²	128	143.8 Å²	143.8	78%	0.776	79%	0.788	S	S	*	*			trans	-139.1	130.6	167.5	178.4	0	0	0	0	110.5
13	V	32.6	Very low	33.7	Very low	125 Å²	125	145.3 Å²	145.3	76%	0.758	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.3	136.1	173.8	173.1	0	0	0	0	109.9	P15	V13-P15 WeakPolarHBondContact O-CD 3.46Å
14	V	31.1	Very low	34	Very low	132 Å²	132	149.6 Å²	149.6	80%	0.8	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-97.6	119.1	177.2	-179.1	0	0	0	0	110.4
15	P	32	Very low	34.6	Very low	115 Å²	115	151.8 Å²	151.8	75%	0.747	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.6	135.9	157.9	2.5	17.6	0	0	0	110.3	V13	V13-P15 WeakPolarHBondContact O-CD 3.46Å
16	N	31.8	Very low	34.8	Very low	139 Å²	139	150.8 Å²	150.8	74%	0.743	81%	0.806	S	S	*	*			trans	-89.4	110.3	177.1	178.7	42.2	0	0	0	109.9
17	E	30.7	Very low	35.6	Very low	181 Å²	181	148.4 Å²	148.4	85%	0.846	79%	0.785	S	S	*	*			trans	-144.6	106.6	165	-78.3	-64.6	149.7	0	0	109.1
18	S	31.2	Very low	36.6	Very low	98 Å²	98	148 Å²	148	69%	0.685	79%	0.788	S	S	*	*			trans	-88.1	105.6	174.5	52.1	0	0	0	0	110.3
19	S	31.4	Very low	37.9	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	77%	0.766	S	S	*	*			trans	-85.1	115.9	172.7	53.9	0	0	0	0	111.8
20	F	32.4	Very low	39.1	Very low	198 Å²	198	137.3 Å²	137.3	87%	0.868	76%	0.758	S	S	*	*			trans	-114.5	130	153	-81.3	-77.6	0	0	0	109
21	P	39.1	Very low	40.5	Very low	129 Å²	129	134 Å²	134	84%	0.838	74%	0.741	S	S	*	*			trans	-91.6	109.3	179.3	33.7	-26.9	0	0	0	109.7
22	A	36.6	Very low	41.9	Very low	92 Å²	92	131.9 Å²	131.9	76%	0.76	72%	0.723	S	S	*	*			trans	-120.5	116.2	164.5	0	0	0	0	0	108.9	R24	A22-R24 PolarHBondContact O-N 3.14Å; A22-R24 VanDerWaalsContact O-N 3.14Å
23	V	37.8	Very low	43.3	Very low	136 Å²	136	127.5 Å²	127.5	82%	0.824	70%	0.7	S	S	*	*			trans	-40.9	109.6	-179.7	178.1	0	0	0	0	111.6	R25	V23-R25 PolarHBondContact O-N 3.45Å
24	R	39	Very low	44.6	Very low	245 Å²	245	128.4 Å²	128.4	93%	0.925	69%	0.69	S	S	*	*			trans	-68.5	98.2	166	-77.2	-170.1	176.9	-170.7	0.4	108.5	A22 A26	A22-R24 PolarHBondContact O-N 3.14Å; A22-R24 VanDerWaalsContact O-N 3.14Å; R24-A26 PolarHBondContact O-N 3.04Å
25	R	47.6	Very low	46.2	Very low	199 Å²	199	130.2 Å²	130.2	75%	0.751	68%	0.682	S	S	*	*			trans	-77.1	112.6	159.5	-162.2	178.1	-80	116.7	-7.1	106.2	V23 Y27	V23-R25 PolarHBondContact O-N 3.45Å; R25-Y27 PolarHBondContact O-N 3.44Å
26	A	42.7	Very low	47.7	Very low	85 Å²	85	127 Å²	127	70%	0.702	66%	0.663	S	S	*	*			trans	-66	116.4	175.4	0	0	0	0	0	108.4	R24 T28	R24-A26 PolarHBondContact O-N 3.04Å; A26-T28 PolarHBondContact O-N 3.23Å
27	Y	47.8	Very low	49.3	Very low	122 Å²	122	126.4 Å²	126.4	48%	0.478	65%	0.651	S	S	.	*			trans	-69.1	126	176	-62.2	-80.9	0	0	0	108.8	R25 E32 A33 S36	R25-Y27 PolarHBondContact O-N 3.44Å; Y27-E32 HydrophobicContact CD1-CB 4.33Å; Y27-E32 HydrophobicContact CD1-CG 4.23Å; Y27-A33 HydrophobicContact CD1-CB 4.23Å; Y27-A33 HydrophobicContact CD2-CB 4.17Å; Y27-A33 HydrophobicContact CG-CB 3.89Å; Y27-S36 PolarHBondContact OH-OG 3.44Å; Y27-S36 VanDerWaalsContact OH-OG 3.05Å
28	T	56.5	Low	50.9	Low	129 Å²	129	122.3 Å²	122.3	79%	0.791	64%	0.635	S	S	*	*	S	Bend	trans	-90.9	-5.1	-174.1	61.1	0	0	0	0	112.9	A26 E32	A26-T28 PolarHBondContact O-N 3.23Å; T28-E32 PolarHBondContact N-OE2 3.34Å; T28-E32 PolarHBondContact OG1-OE2 3.25Å
29	S	63.3	Low	52.1	Low	59 Å²	59	125.1 Å²	125.1	41%	0.413	64%	0.637	S	S	.	*	S	Bend	trans	-149.6	151.6	171.4	66.8	0	0	0	0	111	D31 E32 A33	S29-D31 PolarHBondContact O-N 3.05Å; S29-E32 PolarHBondContact O-N 3.18Å; S29-E32 VanDerWaalsContact O-N 3.16Å; S29-E32 PolarHBondContact OG-N 3.16Å; S29-A33 PolarHBondContact O-N 3.33Å
30	E	57.8	Low	54.1	Low	156 Å²	156	122.6 Å²	122.6	73%	0.729	62%	0.615	S	S	*	*	H	α-helix	trans	-58.8	-36.9	176.2	-64.4	-172.9	148.1	0	0	111.2	E32 A33 W34	E30-E32 PolarHBondContact O-N 3.21Å; E30-A33 PolarHBondContact O-N 3.26Å; E30-W34 VanDerWaalsContact C-CD1 3.49Å; E30-W34 PolarHBondContact O-N 3.4Å
31	D	60.1	Low	55.6	Low	101 Å²	101	118.1 Å²	118.1	54%	0.54	61%	0.605	S	S	.	*	H	α-helix	trans	-61.5	-29.7	178.2	-82.3	-3.1	0	0	0	113.5	S29 R35	S29-D31 PolarHBondContact O-N 3.05Å; D31-R35 WeakPolarHBondContact O-CG 3.46Å; D31-R35 PolarHBondContact O-N 3.34Å; D31-R35 VanDerWaalsContact O-N 3.16Å
32	E	65.1	Low	56.6	Low	86 Å²	86	118.1 Å²	118.1	40%	0.402	60%	0.598	S	S	.	*	H	α-helix	trans	-78.7	-36.7	178.7	-158.5	176.2	-160.6	0	0	111.6	Y27 T28 S29 E30 S36	Y27-E32 HydrophobicContact CD1-CB 4.33Å; Y27-E32 HydrophobicContact CD1-CG 4.23Å; T28-E32 PolarHBondContact N-OE2 3.34Å; T28-E32 PolarHBondContact OG1-OE2 3.25Å; S29-E32 PolarHBondContact O-N 3.18Å; S29-E32 VanDerWaalsContact O-N 3.16Å; S29-E32 PolarHBondContact OG-N 3.16Å; E30-E32 PolarHBondContact O-N 3.21Å; E32-S36 PolarHBondContact O-N 3.43Å
33	A	63.5	Low	58.3	Low	37 Å²	37	115.2 Å²	115.2	31%	0.306	57%	0.57	S	S	.	*	H	α-helix	trans	-65.9	-40.1	172.3	0	0	0	0	0	111.5	Y27 S29 E30 S36 Y37	Y27-A33 HydrophobicContact CD1-CB 4.23Å; Y27-A33 HydrophobicContact CD2-CB 4.17Å; Y27-A33 HydrophobicContact CG-CB 3.89Å; S29-A33 PolarHBondContact O-N 3.33Å; E30-A33 PolarHBondContact O-N 3.26Å; A33-S36 PolarHBondContact O-N 3.01Å; A33-Y37 WeakPolarHBondContact O-CB 3.5Å; A33-Y37 PolarHBondContact O-N 3.41Å
34	W	59.3	Low	59.9	Low	144 Å²	144	110.8 Å²	110.8	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-66.6	-40.1	177.4	-71.7	120.5	0	0	0	113.1	E30 Y37 L38	E30-W34 VanDerWaalsContact C-CD1 3.49Å; E30-W34 PolarHBondContact O-N 3.4Å; W34-Y37 PolarHBondContact O-N 2.97Å; W34-L38 WeakPolarHBondContact O-CG 3.47Å; W34-L38 PolarHBondContact O-N 3.01Å
35	R	65	Low	60.8	Low	169 Å²	169	101.1 Å²	101.1	64%	0.638	52%	0.52	S	S	*	.	H	α-helix	trans	-61.1	-46.7	173.7	-79.6	-170.6	-179.3	97	-2.4	111.6	D31 Y37 L38 E39	D31-R35 WeakPolarHBondContact O-CG 3.46Å; D31-R35 PolarHBondContact O-N 3.34Å; D31-R35 VanDerWaalsContact O-N 3.16Å; R35-Y37 VanDerWaalsContact C-N 3.29Å; R35-Y37 PolarHBondContact O-N 3.16Å; R35-L38 PolarHBondContact O-N 3.35Å; R35-E39 WeakPolarHBondContact O-CB 3.49Å; R35-E39 PolarHBondContact O-N 2.95Å
36	S	63.4	Low	61.8	Low	49 Å²	49	95.5 Å²	95.5	34%	0.343	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-30.8	179.1	-166.4	0	0	0	0	113.1	Y27 E32 A33 N40	Y27-S36 PolarHBondContact OH-OG 3.44Å; Y27-S36 VanDerWaalsContact OH-OG 3.05Å; E32-S36 PolarHBondContact O-N 3.43Å; A33-S36 PolarHBondContact O-N 3.01Å; S36-N40 PolarHBondContact O-N 3.26Å
37	Y	66.1	Low	63	Low	125 Å²	125	98 Å²	98	49%	0.49	50%	0.503	S	S	.	.	H	α-helix	trans	-74.7	-36.4	176.2	-172	-97.3	0	0	0	112.8	A33 W34 R35 N40 T43	A33-Y37 WeakPolarHBondContact O-CB 3.5Å; A33-Y37 PolarHBondContact O-N 3.41Å; W34-Y37 PolarHBondContact O-N 2.97Å; R35-Y37 VanDerWaalsContact C-N 3.29Å; R35-Y37 PolarHBondContact O-N 3.16Å; Y37-N40 WeakPolarHBondContact O-CB 3.14Å; Y37-N40 PolarHBondContact O-N 3.04Å; Y37-T43 HydrophobicContact CD1-CG2 4.17Å; Y37-T43 HydrophobicContact CE1-CG2 3.99Å; Y37-T43 WeakPolarHBondContact O-CB 3.06Å; Y37-T43 WeakPolarHBondContact O-CG2 3.35Å; Y37-T43 PolarHBondContact O-OG1 2.7Å
38	L	62.4	Low	63.6	Low	96 Å²	96	94.2 Å²	94.2	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-76.5	-27.3	176.8	-73.4	169.8	0	0	0	113.1	W34 R35 N40	W34-L38 WeakPolarHBondContact O-CG 3.47Å; W34-L38 PolarHBondContact O-N 3.01Å; R35-L38 PolarHBondContact O-N 3.35Å; L38-N40 VanDerWaalsContact C-N 3.35Å
39	E	57.3	Low	63.7	Low	157 Å²	157	94.8 Å²	94.8	73%	0.734	49%	0.493	S	S	*	.	S	Bend	trans	-84.1	-6.2	172.3	-77.1	-173.3	151.8	0	0	113.7	R35 P41	R35-E39 WeakPolarHBondContact O-CB 3.49Å; R35-E39 PolarHBondContact O-N 2.95Å; E39-P41 WeakPolarHBondContact O-CD 3.35Å
40	N	74.3	Confident	63.4	Low	61 Å²	61	96.2 Å²	96.2	33%	0.326	49%	0.494	S	S	.	.	S	Bend	trans	-58.2	125.8	173.5	179.3	-22.9	0	0	0	109.1	S36 Y37 L38 L42 T43 A44	S36-N40 PolarHBondContact O-N 3.26Å; Y37-N40 WeakPolarHBondContact O-CB 3.14Å; Y37-N40 PolarHBondContact O-N 3.04Å; L38-N40 VanDerWaalsContact C-N 3.35Å; N40-L42 PolarHBondContact O-N 2.92Å; N40-L42 PolarHBondContact OD1-N 3.47Å; N40-T43 PolarHBondContact O-N 3Å; N40-A44 WeakPolarHBondContact O-CB 3.44Å; N40-A44 PolarHBondContact O-N 2.81Å
41	P	62.8	Low	63.3	Low	103 Å²	103	92.5 Å²	92.5	67%	0.669	49%	0.485	S	S	*	.	H	α-helix	trans	-52.1	-34.4	-177.3	-27.1	33	0	0	0	113.7	E39 A45	E39-P41 WeakPolarHBondContact O-CD 3.35Å; P41-A45 WeakPolarHBondContact O-CB 3.38Å; P41-A45 PolarHBondContact O-N 2.84Å
42	L	60.8	Low	63	Low	130 Å²	130	93.8 Å²	93.8	68%	0.681	49%	0.491	S	S	*	.	H	α-helix	trans	-72.7	-40.4	177.6	-69.9	166.9	0	0	0	112.1	N40 T46	N40-L42 PolarHBondContact O-N 2.92Å; N40-L42 PolarHBondContact OD1-N 3.47Å; L42-T46 WeakPolarHBondContact O-CB 3.47Å; L42-T46 PolarHBondContact O-N 3.06Å; L42-T46 PolarHBondContact O-OG1 2.9Å
43	T	72.7	Confident	62.4	Low	30 Å²	30	96.1 Å²	96.1	18%	0.184	51%	0.506	C	S	.	.	H	α-helix	trans	-70.2	-44.1	177	-48.8	0	0	0	0	111	Y37 N40 T46 K47	Y37-T43 HydrophobicContact CD1-CG2 4.17Å; Y37-T43 HydrophobicContact CE1-CG2 3.99Å; Y37-T43 WeakPolarHBondContact O-CB 3.06Å; Y37-T43 WeakPolarHBondContact O-CG2 3.35Å; Y37-T43 PolarHBondContact O-OG1 2.7Å; N40-T43 PolarHBondContact O-N 3Å; T43-T46 PolarHBondContact O-N 3.39Å; T43-K47 WeakPolarHBondContact O-CB 3.24Å; T43-K47 PolarHBondContact O-N 2.94Å
44	A	69.4	Low	62	Low	43 Å²	43	98 Å²	98	36%	0.355	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-43.5	175.8	0	0	0	0	0	111.3	N40 K47 A48	N40-A44 WeakPolarHBondContact O-CB 3.44Å; N40-A44 PolarHBondContact O-N 2.81Å; A44-K47 PolarHBondContact O-N 3.33Å; A44-A48 VanDerWaalsContact O-CB 3.24Å; A44-A48 WeakPolarHBondContact O-CB 3.37Å; A44-A48 PolarHBondContact O-N 2.89Å
45	A	59	Low	61.6	Low	42 Å²	42	95.6 Å²	95.6	35%	0.347	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-41.6	175	0	0	0	0	0	112.1	P41 A48 M49	P41-A45 WeakPolarHBondContact O-CB 3.38Å; P41-A45 PolarHBondContact O-N 2.84Å; A45-A48 PolarHBondContact O-N 3.45Å; A45-M49 WeakPolarHBondContact O-CB 3.28Å; A45-M49 VanDerWaalsContact O-CG 3.3Å; A45-M49 WeakPolarHBondContact O-CG 3.39Å; A45-M49 PolarHBondContact O-N 3.36Å
46	T	68.2	Low	61.2	Low	82 Å²	82	95.4 Å²	95.4	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-63.8	-45.3	177	-56.3	0	0	0	0	111	L42 T43 A48 M49 M50	L42-T46 WeakPolarHBondContact O-CB 3.47Å; L42-T46 PolarHBondContact O-N 3.06Å; L42-T46 PolarHBondContact O-OG1 2.9Å; T43-T46 PolarHBondContact O-N 3.39Å; T46-A48 PolarHBondContact O-N 3.19Å; T46-M49 PolarHBondContact O-N 2.88Å; T46-M50 HydrophobicContact CG2-SD 4.36Å; T46-M50 VanDerWaalsContact O-CG 3.29Å; T46-M50 WeakPolarHBondContact O-CG 3.5Å; T46-M50 PolarHBondContact O-N 2.8Å
47	K	68.4	Low	60.9	Low	136 Å²	136	98.1 Å²	98.1	59%	0.591	54%	0.544	S	S	*	.	H	α-helix	trans	-61.8	-43.3	174.8	-173.2	-176.3	177.7	-168.2	0	111.9	T43 A44 M50 S51	T43-K47 WeakPolarHBondContact O-CB 3.24Å; T43-K47 PolarHBondContact O-N 2.94Å; A44-K47 PolarHBondContact O-N 3.33Å; K47-M50 PolarHBondContact O-N 3.23Å; K47-S51 WeakPolarHBondContact O-CB 3.3Å; K47-S51 PolarHBondContact O-N 3.02Å; K47-S51 VanDerWaalsContact O-N 3.1Å; K47-S51 PolarHBondContact O-OG 3.16Å
48	A	60.8	Low	60.4	Low	43 Å²	43	93.8 Å²	93.8	36%	0.355	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-47.5	176.6	0	0	0	0	0	110.9	A44 A45 T46 M50 S51 I52	A44-A48 VanDerWaalsContact O-CB 3.24Å; A44-A48 WeakPolarHBondContact O-CB 3.37Å; A44-A48 PolarHBondContact O-N 2.89Å; A45-A48 PolarHBondContact O-N 3.45Å; T46-A48 PolarHBondContact O-N 3.19Å; A48-M50 VanDerWaalsContact C-N 3.28Å; A48-M50 PolarHBondContact O-N 3.32Å; A48-S51 WeakPolarHBondContact CA-OG 3.4Å; A48-S51 PolarHBondContact O-N 3.3Å; A48-S51 PolarHBondContact O-OG 2.82Å; A48-I52 WeakPolarHBondContact O-CD1 3.29Å; A48-I52 VanDerWaalsContact O-CG1 3.22Å; A48-I52 WeakPolarHBondContact O-CG1 3.44Å; A48-I52 PolarHBondContact O-N 3.43Å; A48-I52 VanDerWaalsContact O-N 3.14Å
49	M	56.9	Low	60	Low	141 Å²	141	92.1 Å²	92.1	70%	0.695	53%	0.532	S	S	*	.	H	α-helix	trans	-59.1	-36.9	176.2	-74.6	-161	-149.6	0	0	112.9	A45 T46 S51	A45-M49 WeakPolarHBondContact O-CB 3.28Å; A45-M49 VanDerWaalsContact O-CG 3.3Å; A45-M49 WeakPolarHBondContact O-CG 3.39Å; A45-M49 PolarHBondContact O-N 3.36Å; T46-M49 PolarHBondContact O-N 2.88Å; M49-S51 VanDerWaalsContact C-N 3.31Å; M49-S51 PolarHBondContact O-N 3.48Å
50	M	58.6	Low	59.9	Low	89 Å²	89	89.9 Å²	89.9	44%	0.438	53%	0.525	S	S	.	.	H	α-helix	trans	-71.5	-23.8	174.6	-67.3	179.8	85.2	0	0	113.1	T46 K47 A48 S58 A61	T46-M50 HydrophobicContact CG2-SD 4.36Å; T46-M50 VanDerWaalsContact O-CG 3.29Å; T46-M50 WeakPolarHBondContact O-CG 3.5Å; T46-M50 PolarHBondContact O-N 2.8Å; K47-M50 PolarHBondContact O-N 3.23Å; A48-M50 VanDerWaalsContact C-N 3.28Å; A48-M50 PolarHBondContact O-N 3.32Å; M50-S58 PolarHBondContact O-OG 3.15Å; M50-A61 HydrophobicContact CE-CB 3.92Å
51	S	55.8	Low	59.1	Low	78 Å²	78	88.5 Å²	88.5	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-93.5	-14.5	-177.1	68.9	0	0	0	0	115.5	K47 A48 M49 N53 G54	K47-S51 WeakPolarHBondContact O-CB 3.3Å; K47-S51 PolarHBondContact O-N 3.02Å; K47-S51 VanDerWaalsContact O-N 3.1Å; K47-S51 PolarHBondContact O-OG 3.16Å; A48-S51 WeakPolarHBondContact CA-OG 3.4Å; A48-S51 PolarHBondContact O-N 3.3Å; A48-S51 PolarHBondContact O-OG 2.82Å; M49-S51 VanDerWaalsContact C-N 3.31Å; M49-S51 PolarHBondContact O-N 3.48Å; S51-N53 PolarHBondContact O-N 3.34Å; S51-G54 PolarHBondContact O-N 3.3Å
52	I	53.2	Low	58.9	Low	128 Å²	128	87.4 Å²	87.4	66%	0.656	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-17.3	-172.8	-75.5	161.1	0	0	0	113.4	A48	A48-I52 WeakPolarHBondContact O-CD1 3.29Å; A48-I52 VanDerWaalsContact O-CG1 3.22Å; A48-I52 WeakPolarHBondContact O-CG1 3.44Å; A48-I52 PolarHBondContact O-N 3.43Å; A48-I52 VanDerWaalsContact O-N 3.14Å
53	N	51.3	Low	58.9	Low	135 Å²	135	82.3 Å²	82.3	72%	0.722	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-2.7	-178.9	-78.9	99.7	0	0	0	116.2	S51 D55	S51-N53 PolarHBondContact O-N 3.34Å; N53-D55 PolarHBondContact O-N 2.99Å
54	G	55.8	Low	58.4	Low	77 Å²	77	87.1 Å²	87.1	79%	0.794	51%	0.513	S	S	*	.			trans	48.5	38.6	173.9	0	0	0	0	0	113.8	S51	S51-G54 PolarHBondContact O-N 3.3Å
55	D	52	Low	57.9	Low	93 Å²	93	89.8 Å²	89.8	50%	0.497	52%	0.521	S	S	.	.			trans	-103.8	132	-178.2	-154.3	-15.1	0	0	0	108.8	N53 D57 S58	N53-D55 PolarHBondContact O-N 2.99Å; D55-D57 PolarHBondContact O-N 3.32Å; D55-S58 VanDerWaalsContact O-CB 3.28Å; D55-S58 WeakPolarHBondContact O-CB 3.44Å; D55-S58 PolarHBondContact O-N 2.8Å; D55-S58 PolarHBondContact O-OG 3.14Å
56	E	56.8	Low	58.2	Low	165 Å²	165	92.1 Å²	92.1	77%	0.771	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.3	-177.7	-73.1	-84.9	125.8	0	0	112.2	S58 A59	E56-S58 PolarHBondContact O-N 3.34Å; E56-A59 WeakPolarHBondContact O-CB 3.49Å; E56-A59 PolarHBondContact O-N 2.96Å; E56-A59 VanDerWaalsContact O-N 3.13Å
57	D	56.4	Low	57.9	Low	107 Å²	107	92.7 Å²	92.7	57%	0.572	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-21.1	173.3	-77	-24.9	0	0	0	113.8	D55 A59 N60 A61	D55-D57 PolarHBondContact O-N 3.32Å; D57-A59 VanDerWaalsContact C-N 3.3Å; D57-A59 PolarHBondContact O-N 3.34Å; D57-N60 PolarHBondContact O-N 3.36Å; D57-A61 PolarHBondContact O-N 3.5Å; D57-A61 VanDerWaalsContact O-N 3.1Å
58	S	55.7	Low	57.3	Low	34 Å²	34	95 Å²	95	24%	0.238	53%	0.528	C	S	.	.	H	α-helix	trans	-68.9	-30.8	175.3	-36.7	0	0	0	0	111.8	M50 D55 E56 A61 L62	M50-S58 PolarHBondContact O-OG 3.15Å; D55-S58 VanDerWaalsContact O-CB 3.28Å; D55-S58 WeakPolarHBondContact O-CB 3.44Å; D55-S58 PolarHBondContact O-N 2.8Å; D55-S58 PolarHBondContact O-OG 3.14Å; E56-S58 PolarHBondContact O-N 3.34Å; S58-A61 PolarHBondContact O-N 3.1Å; S58-L62 PolarHBondContact O-N 3.35Å; S58-L62 VanDerWaalsContact O-N 3.14Å
59	A	53.7	Low	56.9	Low	60 Å²	60	99.5 Å²	99.5	50%	0.496	54%	0.537	S	S	.	.	H	α-helix	trans	-72.1	-35	176.1	0	0	0	0	0	111.4	E56 D57 L62 G63	E56-A59 WeakPolarHBondContact O-CB 3.49Å; E56-A59 PolarHBondContact O-N 2.96Å; E56-A59 VanDerWaalsContact O-N 3.13Å; D57-A59 VanDerWaalsContact C-N 3.3Å; D57-A59 PolarHBondContact O-N 3.34Å; A59-L62 PolarHBondContact O-N 3.45Å; A59-G63 PolarHBondContact O-N 3.1Å
60	N	55.7	Low	56.6	Low	110 Å²	110	101.6 Å²	101.6	59%	0.588	54%	0.542	S	S	*	.	H	α-helix	trans	-68.1	-38.8	173	-76.3	-19.6	0	0	0	112.2	D57 G63 L64	D57-N60 PolarHBondContact O-N 3.36Å; N60-G63 PolarHBondContact O-N 2.93Å; N60-L64 PolarHBondContact O-N 3.49Å
61	A	57.1	Low	56.3	Low	33 Å²	33	99.4 Å²	99.4	27%	0.273	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-38	175.1	0	0	0	0	0	112.5	M50 D57 S58 G63 L64 L65	M50-A61 HydrophobicContact CE-CB 3.92Å; D57-A61 PolarHBondContact O-N 3.5Å; D57-A61 VanDerWaalsContact O-N 3.1Å; S58-A61 PolarHBondContact O-N 3.1Å; A61-G63 VanDerWaalsContact C-N 3.35Å; A61-L64 PolarHBondContact O-N 2.88Å; A61-L65 PolarHBondContact O-N 3.09Å; A61-L65 VanDerWaalsContact O-N 3.09Å
62	L	57.6	Low	56	Low	79 Å²	79	99.3 Å²	99.3	41%	0.414	53%	0.531	S	S	.	.	H	α-helix	trans	-65.6	-37.8	171.8	-80	164.1	0	0	0	111.8	S58 A59 L65 Y66	S58-L62 PolarHBondContact O-N 3.35Å; S58-L62 VanDerWaalsContact O-N 3.14Å; A59-L62 PolarHBondContact O-N 3.45Å; L62-L65 PolarHBondContact O-N 3.46Å; L62-Y66 HydrophobicContact CB-CD2 4.43Å; L62-Y66 HydrophobicContact CB-CE2 4.11Å; L62-Y66 HydrophobicContact CD2-CE2 4.49Å; L62-Y66 WeakPolarHBondContact O-CD2 3.38Å; L62-Y66 PolarHBondContact O-N 3.5Å
63	G	60.7	Low	56	Low	24 Å²	24	101.2 Å²	101.2	25%	0.247	54%	0.535	C	S	.	.	H	α-helix	trans	-57.4	-46.7	172.9	0	0	0	0	0	113	A59 N60 A61 L65 Y66 D67	A59-G63 PolarHBondContact O-N 3.1Å; N60-G63 PolarHBondContact O-N 2.93Å; A61-G63 VanDerWaalsContact C-N 3.35Å; G63-L65 VanDerWaalsContact C-N 3.33Å; G63-L65 PolarHBondContact O-N 2.96Å; G63-Y66 PolarHBondContact O-N 3.24Å; G63-D67 WeakPolarHBondContact O-CB 3.01Å; G63-D67 PolarHBondContact O-N 3.49Å
64	L	63.7	Low	56.1	Low	130 Å²	130	103.4 Å²	103.4	68%	0.681	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-37.3	175.7	-70.3	171.5	0	0	0	112.4	N60 A61 D67 Y68	N60-L64 PolarHBondContact O-N 3.49Å; A61-L64 PolarHBondContact O-N 2.88Å; L64-D67 PolarHBondContact O-N 3.31Å; L64-Y68 WeakPolarHBondContact O-CB 3.49Å; L64-Y68 PolarHBondContact O-N 3.24Å
65	L	59.4	Low	55.9	Low	100 Å²	100	107.3 Å²	107.3	52%	0.524	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-44.4	175.2	-130.8	91.5	0	0	0	111.5	A61 L62 G63 D67 Y68 Y69	A61-L65 PolarHBondContact O-N 3.09Å; A61-L65 VanDerWaalsContact O-N 3.09Å; L62-L65 PolarHBondContact O-N 3.46Å; G63-L65 VanDerWaalsContact C-N 3.33Å; G63-L65 PolarHBondContact O-N 2.96Å; L65-D67 VanDerWaalsContact C-N 3.31Å; L65-D67 PolarHBondContact O-N 2.96Å; L65-Y68 PolarHBondContact O-N 2.77Å; L65-Y69 HydrophobicContact CG-CE2 4.41Å; L65-Y69 VanDerWaalsContact O-CD2 3.28Å; L65-Y69 WeakPolarHBondContact O-CD2 3.22Å; L65-Y69 PolarHBondContact O-N 3.46Å; L65-Y69 VanDerWaalsContact O-N 3.1Å
66	Y	65.2	Low	56.3	Low	91 Å²	91	106.6 Å²	106.6	36%	0.357	53%	0.526	S	S	.	.	H	α-helix	trans	-65.8	-33.5	177.8	-71.3	-50.2	0	0	0	112.7	L62 G63 K70 V71 R76	L62-Y66 HydrophobicContact CB-CD2 4.43Å; L62-Y66 HydrophobicContact CB-CE2 4.11Å; L62-Y66 HydrophobicContact CD2-CE2 4.49Å; L62-Y66 WeakPolarHBondContact O-CD2 3.38Å; L62-Y66 PolarHBondContact O-N 3.5Å; G63-Y66 PolarHBondContact O-N 3.24Å; Y66-K70 WeakPolarHBondContact O-CA 3.28Å; Y66-K70 PolarHBondContact O-N 3.19Å; Y66-V71 HydrophobicContact CD1-CB 3.95Å; Y66-V71 HydrophobicContact CD1-CG1 4.2Å; Y66-V71 HydrophobicContact CD1-CG2 3.84Å; Y66-V71 PolarHBondContact O-N 3.45Å; Y66-R76 HydrophobicContact CD2-CG 4.36Å; Y66-R76 HydrophobicContact CG-CG 4.47Å
67	D	60.1	Low	55.8	Low	94 Å²	94	104.6 Å²	104.6	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-75.5	-36.6	175.6	-75.7	-4.8	0	0	0	112	G63 L64 L65 Y69 K70 R76	G63-D67 WeakPolarHBondContact O-CB 3.01Å; G63-D67 PolarHBondContact O-N 3.49Å; L64-D67 PolarHBondContact O-N 3.31Å; L65-D67 VanDerWaalsContact C-N 3.31Å; L65-D67 PolarHBondContact O-N 2.96Å; D67-Y69 VanDerWaalsContact C-N 3.32Å; D67-Y69 PolarHBondContact O-N 3.42Å; D67-K70 PolarHBondContact O-N 3.02Å; D67-R76 IonicContact OD1-CZ 3.86Å; D67-R76 IonicContact OD1-NH1 2.96Å; D67-R76 PolarHBondContact OD1-NH1 3.49Å; D67-R76 IonicContact OD1-NH2 2.75Å; D67-R76 PolarHBondContact OD1-NH2 2.69Å
68	Y	56.1	Low	54.8	Low	183 Å²	183	107.4 Å²	107.4	72%	0.718	54%	0.539	S	S	*	.	H	α-helix	trans	-60.4	-40.3	172.7	-177.5	-97	0	0	0	112.1	L64 L65	L64-Y68 WeakPolarHBondContact O-CB 3.49Å; L64-Y68 PolarHBondContact O-N 3.24Å; L65-Y68 PolarHBondContact O-N 2.77Å
69	Y	53.1	Low	53.7	Low	138 Å²	138	110.1 Å²	110.1	54%	0.541	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	6.5	176.9	-68.6	-73.4	0	0	0	114.3	L65 D67 V71	L65-Y69 HydrophobicContact CG-CE2 4.41Å; L65-Y69 VanDerWaalsContact O-CD2 3.28Å; L65-Y69 WeakPolarHBondContact O-CD2 3.22Å; L65-Y69 PolarHBondContact O-N 3.46Å; L65-Y69 VanDerWaalsContact O-N 3.1Å; D67-Y69 VanDerWaalsContact C-N 3.32Å; D67-Y69 PolarHBondContact O-N 3.42Å; Y69-V71 VanDerWaalsContact C-N 3.34Å; Y69-V71 PolarHBondContact O-N 3.05Å
70	K	51.8	Low	52.5	Low	185 Å²	185	114.8 Å²	114.8	80%	0.804	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.8	41.4	178.6	-59.8	-163.2	176.8	-173	0	115.3	Y66 D67	Y66-K70 WeakPolarHBondContact O-CA 3.28Å; Y66-K70 PolarHBondContact O-N 3.19Å; D67-K70 PolarHBondContact O-N 3.02Å
71	V	52.4	Low	51.4	Low	44 Å²	44	114.8 Å²	114.8	27%	0.267	59%	0.585	S	S	.	*			trans	-70.4	127	179.9	-179.6	0	0	0	0	110.8	Y66 Y69 R76	Y66-V71 HydrophobicContact CD1-CB 3.95Å; Y66-V71 HydrophobicContact CD1-CG1 4.2Å; Y66-V71 HydrophobicContact CD1-CG2 3.84Å; Y66-V71 PolarHBondContact O-N 3.45Å; Y69-V71 VanDerWaalsContact C-N 3.34Å; Y69-V71 PolarHBondContact O-N 3.05Å; V71-R76 PolarHBondContact O-NE 3.14Å; V71-R76 PolarHBondContact O-NH2 3.5Å
72	P	48.2	Very low	50.2	Low	75 Å²	75	123 Å²	123	49%	0.487	61%	0.614	S	S	.	*			trans	-57.2	138.8	178.2	-25.8	34.6	0	0	0	112.8	E74 K75	P72-E74 PolarHBondContact O-N 3.13Å; P72-E74 VanDerWaalsContact O-N 3.16Å; P72-K75 PolarHBondContact O-N 3.06Å; P72-K75 VanDerWaalsContact O-N 3.15Å
73	K	52.7	Low	48.8	Very low	169 Å²	169	126 Å²	126	74%	0.735	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-60.2	-29.4	-171.5	-67.7	-176.1	178	-178.1	0	113.5	K75 R76	K73-K75 PolarHBondContact O-N 3.23Å; K73-R76 PolarHBondContact O-N 3.35Å
74	E	53.1	Low	47.1	Very low	180 Å²	180	128.9 Å²	128.9	84%	0.841	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-64.8	-24.1	-179.8	-64.5	143.2	-147.3	0	0	113.6	P72	P72-E74 PolarHBondContact O-N 3.13Å; P72-E74 VanDerWaalsContact O-N 3.16Å
75	K	52.6	Low	45.4	Very low	160 Å²	160	131.9 Å²	131.9	70%	0.696	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-93.7	4.1	-178.8	-64.5	-168.7	177	-173.6	0	113.9	P72 K73 V77	P72-K75 PolarHBondContact O-N 3.06Å; P72-K75 VanDerWaalsContact O-N 3.15Å; K73-K75 PolarHBondContact O-N 3.23Å; K75-V77 PolarHBondContact O-N 2.94Å
76	R	60.1	Low	44	Very low	77 Å²	77	134.6 Å²	134.6	29%	0.291	68%	0.681	S	S	.	*	S	Bend	trans	-88.1	8.6	-173.9	-61.4	-175.7	-169	-173.4	-2.4	114.8	Y66 D67 V71 K73	Y66-R76 HydrophobicContact CD2-CG 4.36Å; Y66-R76 HydrophobicContact CG-CG 4.47Å; D67-R76 IonicContact OD1-CZ 3.86Å; D67-R76 IonicContact OD1-NH1 2.96Å; D67-R76 PolarHBondContact OD1-NH1 3.49Å; D67-R76 IonicContact OD1-NH2 2.75Å; D67-R76 PolarHBondContact OD1-NH2 2.69Å; V71-R76 PolarHBondContact O-NE 3.14Å; V71-R76 PolarHBondContact O-NH2 3.5Å; K73-R76 PolarHBondContact O-N 3.35Å
77	V	46	Very low	42.5	Very low	123 Å²	123	135.3 Å²	135.3	75%	0.745	70%	0.697	S	S	*	*			trans	-125.4	118.2	179.1	-175.3	0	0	0	0	110.1	K75	K75-V77 PolarHBondContact O-N 2.94Å
78	L	36.8	Very low	40.9	Very low	166 Å²	166	140.5 Å²	140.5	87%	0.869	72%	0.718	S	S	*	*			trans	-117.2	118.9	164.5	-77.8	170.9	0	0	0	108.7
79	A	30.9	Very low	39.6	Very low	92 Å²	92	139 Å²	139	76%	0.76	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.9	133.4	172.5	0	0	0	0	0	110.2	P81	A79-P81 WeakPolarHBondContact O-CD 3.42Å
80	I	29.9	Very low	38.9	Very low	157 Å²	157	137.6 Å²	137.6	81%	0.805	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-75.9	119.7	173.8	-61.6	168.2	0	0	0	108.3
81	P	31.7	Very low	37.8	Very low	111 Å²	111	135.6 Å²	135.6	72%	0.721	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-80.5	122.1	164.2	3.5	15.2	0	0	0	108.5	A79 V83	A79-P81 WeakPolarHBondContact O-CD 3.42Å; P81-V83 PolarHBondContact O-N 3.1Å
82	K	31.4	Very low	36.7	Very low	204 Å²	204	142 Å²	142	89%	0.887	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-62	123.9	164.6	-78.4	179.9	175.1	177.8	0	108.5	A84	K82-A84 PolarHBondContact O-N 3.06Å
83	V	28.4	Very low	35.7	Very low	142 Å²	142	149.6 Å²	149.6	86%	0.861	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.5	168.4	173.3	0	0	0	0	108.1	P81	P81-V83 PolarHBondContact O-N 3.1Å
84	A	26.3	Very low	34.9	Very low	85 Å²	85	146.9 Å²	146.9	70%	0.702	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-86.9	126.5	171.2	0	0	0	0	0	109.4	K82	K82-A84 PolarHBondContact O-N 3.06Å
85	E	28	Very low	33.6	Very low	193 Å²	193	144.3 Å²	144.3	90%	0.902	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-82.3	139.1	159.2	-70.8	-178.7	163.2	0	0	108.6
86	I	30.3	Very low	32.3	Very low	158 Å²	158	144.3 Å²	144.3	81%	0.81	77%	0.769	S	S	*	*			trans	-96.7	177.7	-174.5	-26.7	178.4	0	0	0	109.7
87	P	33.4	Very low	31.5	Very low	106 Å²	106	145.1 Å²	145.1	69%	0.688	79%	0.785	S	S	*	*				-120.2	156.4	-103.7	39.6	-22.8	0	0	0	113.8
88	E	26.6	Very low	30.7	Very low	203 Å²	203	146.6 Å²	146.6	95%	0.949	79%	0.789	S	S	*	*			trans	-147.8	113.6	143.3	-75.1	-155.6	149.8	0	0	109.3
89	D	28.5	Very low	30.1	Very low	151 Å²	151	146 Å²	146	81%	0.807	79%	0.786	S	S	*	*			trans	-86.4	160.4	162	-123.9	-21.4	0	0	0	107.1
90	P	38.1	Very low	30.7	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	78%	0.779	S	S	*	*			cis	-149.2	158.4	47.2	34.2	-10.5	0	0	0	117
91	E	27.6	Very low	30.6	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.664	78%	0.776	S	S	*	*				148.4	131.8	117.2	-79.7	-156.1	151.7	0	0	114.9
92	K	30.7	Very low	30.5	Very low	178 Å²	178	143.4 Å²	143.4	77%	0.774	77%	0.772	S	S	*	*			trans	93.9	94.1	152.5	-69.6	157.8	-175.6	148.5	0	119.8
93	R	26.5	Very low	30.4	Very low	236 Å²	236	141.7 Å²	141.7	89%	0.891	77%	0.767	S	S	*	*			trans	-44.3	166	137.9	-83.4	-172.6	-146.9	156.7	7.4	112.7
94	P	35.5	Very low	30.3	Very low	111 Å²	111	141.5 Å²	141.5	72%	0.721	76%	0.761	S	S	*	*			cis	-145	158.7	31.4	23.3	4	0	0	0	120.4
95	V	26.8	Very low	30.3	Very low	127 Å²	127	144.9 Å²	144.9	77%	0.77	76%	0.762	S	S	*	*			trans	73.6	104.3	132.6	179.1	0	0	0	0	121.4
96	L	25.2	Very low	30.3	Very low	159 Å²	159	141.1 Å²	141.1	83%	0.832	75%	0.753	S	S	*	*				24.4	169.1	115.6	-70.6	172.2	0	0	0	121.5
97	P	43.3	Very low	30.1	Very low	94 Å²	94	141.6 Å²	141.6	61%	0.61	75%	0.752	S	S	*	*			cis	-138	171.1	-6.2	32.4	-10.7	0	0	0	115.7
98	N	28.1	Very low	29.8	Very low	155 Å²	155	142.5 Å²	142.5	83%	0.829	76%	0.756	S	S	*	*				155.9	128.2	118	-89.8	-13.7	0	0	0	114
99	N	25.8	Very low	29.8	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	75%	0.751	S	S	*	*			trans	-70.6	-178.8	162.4	-124.7	5.9	0	0	0	109.8
100	P	42.4	Very low	29.7	Very low	96 Å²	96	138.5 Å²	138.5	62%	0.623	74%	0.74	S	S	*	*			cis	-146.3	179.9	20.2	33.7	-8.7	0	0	0	117.2
101	T	28	Very low	29.2	Very low	121 Å²	121	141 Å²	141	74%	0.742	75%	0.747	S	S	*	*			trans	58.4	144.4	141.9	43.3	0	0	0	0	120
102	S	29	Very low	29.3	Very low	90 Å²	90	144.8 Å²	144.8	63%	0.629	76%	0.755	S	S	*	*			cis	177.1	143.4	2.3	39.1	0	0	0	0	108
103	Q	28.9	Very low	29.1	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	76%	0.761	S	S	*	*			trans	66	117.4	141.8	-68.6	178.2	-16.2	0	0	120.2
104	N	26.3	Very low	29.3	Very low	138 Å²	138	141 Å²	141	74%	0.738	76%	0.76	S	S	*	*				69.3	136.7	99.7	-71.5	6.5	0	0	0	112.8
105	E	27.5	Very low	28.8	Very low	156 Å²	156	142 Å²	142	73%	0.729	76%	0.764	S	S	*	*			cis	-177.5	163.2	33.4	-130.9	168	-158.3	0	0	109.5
106	T	27.2	Very low	28.9	Very low	115 Å²	115	144.3 Å²	144.3	71%	0.706	77%	0.771	S	S	*	*			trans	64.3	148.4	153.4	41.8	0	0	0	0	119.8
107	E	26.3	Very low	29	Very low	167 Å²	167	146 Å²	146	78%	0.78	77%	0.772	S	S	*	*			cis	-171	177.1	5.5	-127	177.3	174.9	0	0	109.9
108	T	26.4	Very low	28.3	Very low	126 Å²	126	147.3 Å²	147.3	77%	0.773	78%	0.783	S	S	*	*			trans	99.8	106.1	163.3	70	0	0	0	0	118
109	L	27.5	Very low	28.4	Very low	161 Å²	161	146 Å²	146	84%	0.843	78%	0.781	S	S	*	*				73	134.9	88.6	-135.8	96.2	0	0	0	111.7
110	D	25.9	Very low	28.7	Very low	109 Å²	109	143.9 Å²	143.9	58%	0.583	78%	0.775	S	S	*	*			cis	-164.2	158	11.6	-158.4	-20.7	0	0	0	106.9
111	N	27.6	Very low	28	Very low	161 Å²	161	146 Å²	146	86%	0.861	79%	0.786	S	S	*	*			trans	168.1	108.3	133.7	-89.1	-37.5	0	0	0	113.1
112	R	30.1	Very low	28	Very low	221 Å²	221	147.1 Å²	147.1	83%	0.834	79%	0.788	S	S	*	*			trans	-72.8	148.7	172.7	-73.9	168	160	167.8	-4.8	112.9
113	V	27.3	Very low	28	Very low	147 Å²	147	151.2 Å²	151.2	89%	0.891	80%	0.801	S	S	*	*			trans	-123.1	134.5	152.4	176.1	0	0	0	0	109.6
114	Q	29.3	Very low	28	Very low	187 Å²	187	148.7 Å²	148.7	87%	0.874	80%	0.802	S	S	*	*			trans	-85	143.2	-168.1	-67	173.2	-4.7	0	0	113
115	V	26.4	Very low	28.1	Very low	132 Å²	132	151 Å²	151	80%	0.8	81%	0.813	S	S	*	*			trans	-87.9	130.7	177.3	171.8	0	0	0	0	109.6
116	L	27.5	Very low	28.1	Very low	177 Å²	177	147 Å²	147	93%	0.927	82%	0.815	S	S	*	*			trans	-113.2	132.6	161.5	-90.2	164.1	0	0	0	110.3
117	K	28.9	Very low	28	Very low	193 Å²	193	147.8 Å²	147.8	84%	0.839	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-77.4	136.8	-164.2	-63.1	168.7	174.5	176.7	0	111.8
118	S	28.2	Very low	28	Very low	122 Å²	122	146.5 Å²	146.5	85%	0.853	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-99.9	132.7	158.6	49.2	0	0	0	0	109.7
119	V	30.2	Very low	28.1	Very low	129 Å²	129	148.2 Å²	148.2	78%	0.782	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.7	141.9	-179.3	-178.3	0	0	0	0	108.9
120	P	32.5	Very low	28.1	Very low	106 Å²	106	149.6 Å²	149.6	69%	0.688	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-81.8	143.7	-176.6	31.4	-33.3	0	0	0	112.9
121	V	26.7	Very low	28.1	Very low	141 Å²	141	152.6 Å²	152.6	86%	0.855	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-93.6	117.8	170.8	178.1	0	0	0	0	108.5
122	N	28.8	Very low	28.7	Very low	145 Å²	145	149.6 Å²	149.6	78%	0.775	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-92.6	134.1	173.4	-85.6	-51.3	0	0	0	110.6
123	L	28.4	Very low	28.6	Very low	175 Å²	175	147.7 Å²	147.7	92%	0.916	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-96.2	125.2	164.1	-76.5	160	0	0	0	108.2
124	S	28.3	Very low	28.7	Very low	114 Å²	114	147.6 Å²	147.6	80%	0.797	81%	0.81	S	S	*	*			trans	-145.7	124.5	167.5	48.8	0	0	0	0	110.7
125	L	29.3	Very low	28.5	Very low	186 Å²	186	144.3 Å²	144.3	97%	0.974	81%	0.806	S	S	*	*			trans	-71.7	148.3	160.6	-90.3	114.1	0	0	0	110.2
126	G	26.3	Very low	28.5	Very low	74 Å²	74	140.7 Å²	140.7	76%	0.763	80%	0.796	S	S	*	*			trans	177.4	112.2	165.8	0	0	0	0	0	113.3
127	T	26.5	Very low	28.7	Very low	131 Å²	131	137.6 Å²	137.6	80%	0.804	79%	0.789	S	S	*	*			trans	-49.2	140.6	162.6	29.6	0	0	0	0	113.6
128	D	26.4	Very low	28.7	Very low	140 Å²	140	134.9 Å²	134.9	75%	0.749	79%	0.789	S	S	*	*				166.3	156	102.2	-108	-45.6	0	0	0	114.2
129	H	28.4	Very low	28.7	Very low	162 Å²	162	132.4 Å²	132.4	75%	0.75	78%	0.783	S	S	*	*			trans	-36.5	142.3	178.2	-73.5	-73.8	0	0	0	119.6
130	Q	25.9	Very low	28.6	Very low	190 Å²	190	135.8 Å²	135.8	89%	0.888	79%	0.79	S	S	*	*				-179.6	114.3	107.4	-101.1	169.5	80.3	0	0	112.8
131	E	27.5	Very low	28.6	Very low	172 Å²	172	135 Å²	135	80%	0.804	79%	0.793	S	S	*	*			trans	-64.4	165.7	145	-109	-170.7	-173.4	0	0	109.3
132	P	38.8	Very low	29.4	Very low	97 Å²	97	134.4 Å²	134.4	63%	0.63	79%	0.792	S	S	*	*				-161.1	-177.8	54.1	45.2	-23.2	0	0	0	119.2
133	K	29.1	Very low	29.6	Very low	181 Å²	181	132.4 Å²	132.4	79%	0.787	80%	0.795	S	S	*	*			trans	80.9	141.9	148.9	-79.9	171	-175.1	-179.3	0	117.5
134	L	28.2	Very low	29.5	Very low	146 Å²	146	127.5 Å²	127.5	76%	0.764	79%	0.787	S	S	*	*			cis	-178.9	137.4	-6.6	-164.8	78.4	0	0	0	102.4
135	C	26.2	Very low	29.5	Very low	117 Å²	117	128.4 Å²	128.4	79%	0.791	79%	0.788	S	S	*	*				155.9	146.3	85.9	-143.3	0	0	0	0	104
136	G	26.8	Very low	29.6	Very low	56 Å²	56	126.8 Å²	126.8	58%	0.577	78%	0.78	S	S	*	*			cis	161.8	126	13.4	0	0	0	0	0	104.3
137	S	31.8	Very low	30.3	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	78%	0.778	S	S	*	*				81.4	133.6	102.1	70.9	0	0	0	0	112.3
138	T	29.2	Very low	31.1	Very low	136 Å²	136	128 Å²	128	83%	0.834	78%	0.776	S	S	*	*			cis	-168.4	143	49.8	31.7	0	0	0	0	107.5
139	G	27.3	Very low	31.2	Very low	71 Å²	71	126.2 Å²	126.2	73%	0.732	78%	0.782	S	S	*	*				125.9	148.3	63.2	0	0	0	0	0	106.2
140	E	28.5	Very low	31.2	Very low	199 Å²	199	125 Å²	125	93%	0.93	79%	0.785	S	S	*	*			cis	-158.3	153.4	16	-70.9	178.5	137.8	0	0	109.4
141	A	31.7	Very low	31.3	Very low	91 Å²	91	120.8 Å²	120.8	75%	0.752	78%	0.783	S	S	*	*			trans	-102.3	171.5	155	0	0	0	0	0	108.4
142	P	44	Very low	31.2	Very low	128 Å²	128	118.3 Å²	118.3	83%	0.831	78%	0.779	S	S	*	*				-150.9	178.9	86.3	27.7	-3.9	0	0	0	112.7
143	A	32.7	Very low	30.5	Very low	102 Å²	102	119.6 Å²	119.6	84%	0.843	79%	0.785	S	S	*	*			cis	-172.4	164.7	-13.4	0	0	0	0	0	108.5
144	G	26.4	Very low	30.3	Very low	73 Å²	73	119.5 Å²	119.5	75%	0.753	79%	0.785	S	S	*	*			trans	126.6	125.9	153.5	0	0	0	0	0	116.6
145	V	29.3	Very low	30.3	Very low	132 Å²	132	117.1 Å²	117.1	80%	0.8	79%	0.786	S	S	*	*			cis	-172.1	122.4	-28.2	147.8	0	0	0	0	105.3
146	D	30.3	Very low	30.3	Very low	152 Å²	152	120 Å²	120	81%	0.813	79%	0.788	S	S	*	*			trans	62.6	158.1	142.9	-74.2	-12	0	0	0	127.5
147	P	41.6	Very low	30.1	Very low	110 Å²	110	123.9 Å²	123.9	71%	0.714	80%	0.8	S	S	*	*			trans	-126.5	-138.9	-139.9	48.5	-32.8	0	0	0	112.7
148	P	43.6	Very low	29.8	Very low	120 Å²	120	129.2 Å²	129.2	78%	0.779	80%	0.804	S	S	*	*			cis	-126.7	171.4	-34.5	35.7	-18.8	0	0	0	113.6
149	A	28.4	Very low	29.5	Very low	104 Å²	104	126.7 Å²	126.7	86%	0.86	80%	0.798	S	S	*	*			trans	-150.5	132.3	158.3	0	0	0	0	0	113.3
150	V	27.7	Very low	30	Very low	135 Å²	135	128.4 Å²	128.4	82%	0.818	80%	0.796	S	S	*	*			trans	-84.1	143.4	176.3	173.8	0	0	0	0	109.9	V152	V150-V152 HydrophobicContact CG1-CG2 4.41Å
151	A	28	Very low	29.8	Very low	102 Å²	102	125 Å²	125	84%	0.843	79%	0.789	S	S	*	*			trans	-147.6	132.6	156.8	0	0	0	0	0	111.8
152	V	25.5	Very low	29.6	Very low	120 Å²	120	129.1 Å²	129.1	73%	0.727	79%	0.79	S	S	*	*			trans	-113.7	166	176	-176.5	0	0	0	0	107.8	V150	V150-V152 HydrophobicContact CG1-CG2 4.41Å
153	V	25.1	Very low	28.8	Very low	125 Å²	125	132.4 Å²	132.4	76%	0.758	80%	0.796	S	S	*	*			trans	77.4	143.1	164.8	-115.4	0	0	0	0	116.1
154	K	25.2	Very low	28.5	Very low	179 Å²	179	131.7 Å²	131.7	78%	0.778	79%	0.791	S	S	*	*			cis	-167.3	149.3	21.4	-156.4	163.2	-176.4	-176.6	0	110.7
155	A	27.3	Very low	28.7	Very low	96 Å²	96	132 Å²	132	79%	0.793	79%	0.793	S	S	*	*			trans	-82.9	138.6	163.6	0	0	0	0	0	110.2
156	E	25	Very low	29.1	Very low	177 Å²	177	132.2 Å²	132.2	83%	0.827	80%	0.798	S	S	*	*			trans	-117.1	121.2	169.9	-80.8	-168.8	154.8	0	0	111.4
157	V	24.4	Very low	28.9	Very low	137 Å²	137	128.2 Å²	128.2	83%	0.83	79%	0.792	S	S	*	*			trans	-97.2	130.8	160.3	165.8	0	0	0	0	105.9
158	Y	23.8	Very low	28.1	Very low	224 Å²	224	131.7 Å²	131.7	88%	0.878	80%	0.804	S	S	*	*			trans	-149	114.9	164	-136.7	-90	0	0	0	113.2
159	A	24.5	Very low	27.4	Very low	84 Å²	84	134.2 Å²	134.2	69%	0.694	81%	0.805	S	S	*	*			trans	-158.5	158.4	144.8	0	0	0	0	0	105.1
160	P	36.9	Very low	27.2	Very low	106 Å²	106	140.8 Å²	140.8	69%	0.688	81%	0.809	S	S	*	*			cis	-133.6	-171.5	4.8	35	-13.1	0	0	0	113.1
161	V	25.4	Very low	27.1	Very low	129 Å²	129	145 Å²	145	78%	0.782	81%	0.81	S	S	*	*				175	129.5	126.9	158.5	0	0	0	0	112.7
162	F	27.1	Very low	27	Very low	177 Å²	177	146 Å²	146	78%	0.776	81%	0.806	S	S	*	*			trans	-9.5	152.5	160.7	-76.1	-98.4	0	0	0	124.2
163	M	26	Very low	27	Very low	196 Å²	196	149.4 Å²	149.4	97%	0.966	81%	0.814	S	S	*	*				-143.7	144	122.9	-84.9	-118.4	-96.6	0	0	111.1
164	A	28.2	Very low	27.1	Very low	88 Å²	88	146.6 Å²	146.6	73%	0.727	81%	0.81	S	S	*	*			trans	-132.1	145.2	-176.4	0	0	0	0	0	112.1
165	G	29.7	Very low	27.2	Very low	78 Å²	78	147 Å²	147	80%	0.804	82%	0.815	S	S	*	*			trans	88.8	157.1	151.7	0	0	0	0	0	117.6
166	P	37	Very low	27.2	Very low	138 Å²	138	151.2 Å²	151.2	90%	0.896	82%	0.818	S	S	*	*			cis	-121.3	170.1	11.3	36.2	-18.6	0	0	0	112.3
167	G	26.7	Very low	27.4	Very low	68 Å²	68	154.2 Å²	154.2	70%	0.701	82%	0.822	S	S	*	*			cis	121.4	107.2	23.1	0	0	0	0	0	108.6
168	L	25.7	Very low	27.5	Very low	183 Å²	183	154 Å²	154	96%	0.958	82%	0.82	S	S	*	*			trans	-148.8	130.8	157.7	-132.5	94.6	0	0	0	110.9
169	H	27	Very low	27.6	Very low	173 Å²	173	149 Å²	149	80%	0.801	81%	0.813	S	S	*	*			trans	-77.4	152.7	-176.8	-81.8	-98.9	0	0	0	113.6
170	Y	25	Very low	27.6	Very low	242 Å²	242	153.4 Å²	153.4	95%	0.949	81%	0.813	S	S	*	*				-153.9	151.4	124.8	-112.5	-83.7	0	0	0	110.6
171	R	24.9	Very low	26.9	Very low	222 Å²	222	156.6 Å²	156.6	84%	0.838	82%	0.819	S	S	*	*			trans	-122.2	136.3	-159.3	-172.3	-164.1	178.2	176.7	-0.2	110.1
172	V	26.4	Very low	26.8	Very low	124 Å²	124	157.2 Å²	157.2	75%	0.752	81%	0.813	S	S	*	*			trans	36.9	140.8	140.9	-172.7	0	0	0	0	122.3
173	E	25.5	Very low	26.8	Very low	192 Å²	192	153.9 Å²	153.9	90%	0.897	81%	0.811	S	S	*	*			trans	127.4	138.9	144.1	-112.2	166.7	-155.6	0	0	111.3
174	G	26.5	Very low	27.5	Very low	65 Å²	65	148.6 Å²	148.6	67%	0.67	79%	0.792	S	S	*	*			cis	-179.3	158.9	4	0	0	0	0	0	108.6
175	E	27.9	Very low	27.5	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	80%	0.799	S	S	*	*			trans	30.9	129	153.7	-54.6	-173	142.2	0	0	122.7
176	E	26.7	Very low	27.2	Very low	183 Å²	183	159.6 Å²	159.6	86%	0.855	80%	0.799	S	S	*	*				178.7	145.3	100.4	-100.9	-169.5	157.3	0	0	113.4
177	R	29.7	Very low	26.7	Very low	241 Å²	241	158.8 Å²	158.8	91%	0.909	79%	0.792	S	S	*	*			trans	-85.9	136.3	164.9	-74.5	171.4	166.1	155	-4.3	108.7
178	V	27.2	Very low	26.7	Very low	132 Å²	132	160.8 Å²	160.8	80%	0.8	79%	0.79	S	S	*	*			trans	-146.9	138.3	148.6	-178.1	0	0	0	0	110.9
179	V	26.5	Very low	26.8	Very low	120 Å²	120	159.1 Å²	159.1	73%	0.727	79%	0.788	S	S	*	*			trans	-102.3	157.4	177.3	161.1	0	0	0	0	109
180	Y	22.7	Very low	26.9	Very low	175 Å²	175	156 Å²	156	69%	0.686	78%	0.781	S	S	*	*			trans	79.3	139.6	167.6	-115.3	-111.8	0	0	0	115	Q182	Y180-Q182 PolarHBondContact OH-OE1 3.13Å; Y180-Q182 VanDerWaalsContact OH-OE1 3.13Å
181	E	23.1	Very low	26.8	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	78%	0.776	S	S	*	*			cis	-160.8	158.1	49.4	-176	164	-166.8	0	0	114.1
182	Q	24.4	Very low	27	Very low	141 Å²	141	147.5 Å²	147.5	66%	0.659	77%	0.772	S	S	*	*			trans	-86.8	171.4	178.8	-69.1	172.2	-45.4	0	0	113.6	Y180	Y180-Q182 PolarHBondContact OH-OE1 3.13Å; Y180-Q182 VanDerWaalsContact OH-OE1 3.13Å
183	S	25.1	Very low	27	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	78%	0.775	S	S	*	*			trans	94.2	168	139.5	-133.4	0	0	0	0	117.5
184	P	42.2	Very low	27.1	Very low	85 Å²	85	142.8 Å²	142.8	55%	0.552	77%	0.766	S	S	*	*			cis	-131.9	173.2	-27.3	12.5	12.2	0	0	0	112.8
185	Y	27.7	Very low	27.3	Very low	225 Å²	225	150.7 Å²	150.7	88%	0.882	78%	0.777	S	S	*	*				172.2	133.9	109.8	-92.9	-72.3	0	0	0	113.7
186	E	23.9	Very low	27.4	Very low	173 Å²	173	149 Å²	149	81%	0.808	77%	0.771	S	S	*	*			trans	-89.1	153.1	-175.8	-85.7	179.2	133	0	0	114.4
187	V	26.1	Very low	27.6	Very low	121 Å²	121	147.8 Å²	147.8	73%	0.733	76%	0.763	S	S	*	*				44.9	133.6	121.4	-162.6	0	0	0	0	117.2
188	T	26.5	Very low	27.5	Very low	109 Å²	109	142.5 Å²	142.5	67%	0.669	75%	0.748	S	S	*	*			cis	-171.9	163.8	32	-20.6	0	0	0	0	108.3
189	T	28.6	Very low	27.7	Very low	148 Å²	148	141.5 Å²	141.5	91%	0.908	74%	0.739	S	S	*	*				-179.1	146.8	122	30.7	0	0	0	0	112
190	V	27.4	Very low	28	Very low	108 Å²	108	143.2 Å²	143.2	66%	0.655	74%	0.739	S	S	*	*			trans	-97.1	151.5	-169.7	169.9	0	0	0	0	110.9
191	S	23.3	Very low	28.1	Very low	122 Å²	122	143.5 Å²	143.5	85%	0.853	75%	0.746	S	S	*	*			trans	-172.9	145.9	139.4	-79.1	0	0	0	0	114.1
192	H	30.7	Very low	28.7	Very low	164 Å²	164	140.7 Å²	140.7	76%	0.759	75%	0.746	S	S	*	*			trans	-86.3	158.1	-155.7	-63.3	-100.1	0	0	0	116.4
193	S	26.1	Very low	29.3	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	75%	0.752	S	S	*	*				165	150.3	84.7	44	0	0	0	0	106.9
194	S	27	Very low	30.1	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	75%	0.754	S	S	*	*				-175.6	153.6	52.4	58.6	0	0	0	0	113.5
195	Y	31.2	Very low	29.4	Very low	231 Å²	231	143.8 Å²	143.8	91%	0.906	77%	0.768	S	S	*	*			trans	89.1	100.1	159.4	-76.7	-80.7	0	0	0	122.8
196	M	28.8	Very low	29.5	Very low	154 Å²	154	138.2 Å²	138.2	76%	0.759	76%	0.761	S	S	*	*			trans	-47.9	138.9	165.8	-76.2	-70	109.1	0	0	117.6
197	K	31	Very low	30.5	Very low	158 Å²	158	135.5 Å²	135.5	69%	0.687	76%	0.759	S	S	*	*				79.2	148.8	94.2	-107.9	-175.2	177	-128.6	0	113.4
198	E	28.4	Very low	30.5	Very low	129 Å²	129	139.3 Å²	139.3	60%	0.603	76%	0.761	S	S	*	*			cis	-173.8	165.2	5.1	-148.9	164.6	-162.4	0	0	108.5
199	D	30.4	Very low	30.9	Very low	111 Å²	111	141 Å²	141	59%	0.594	76%	0.761	S	S	*	*			trans	68.6	128.2	144.9	-80.4	-41.1	0	0	0	126.2
200	Q	33.1	Very low	31	Very low	157 Å²	157	142.5 Å²	142.5	73%	0.734	76%	0.758	S	S	*	*			trans	44.6	146.4	130.4	-68.2	176.6	64.6	0	0	123.9
201	Q	25.7	Very low	31.3	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	77%	0.766	S	S	*	*			trans	98.4	126.2	152	-88.4	158.3	-13.2	0	0	121.1
202	S	34.3	Very low	31.7	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	77%	0.765	S	S	*	*			trans	-64.1	166.8	173.4	-36.7	0	0	0	0	114.2
203	P	38	Very low	31.8	Very low	122 Å²	122	146.2 Å²	146.2	79%	0.792	77%	0.77	S	S	*	*			trans	-146.1	-170.4	135.7	44.7	-28.2	0	0	0	112.8
204	P	42.2	Very low	32.1	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	77%	0.767	S	S	*	*				-132.8	-175	-90.4	36.7	-14.3	0	0	0	115.8
205	D	27.2	Very low	32.4	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	77%	0.769	S	S	*	*			trans	-28.1	142.1	178.5	-76.1	-46.5	0	0	0	124.4
206	S	30.7	Very low	32.6	Very low	107 Å²	107	148 Å²	148	75%	0.748	77%	0.771	S	S	*	*				60	149.6	123	-148.3	0	0	0	0	120.7
207	P	43.2	Very low	32.6	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	77%	0.77	S	S	*	*			cis	-148.3	156.4	37.3	40.8	-18.6	0	0	0	120.3
208	Y	27.2	Very low	32.9	Very low	200 Å²	200	145.8 Å²	145.8	78%	0.784	77%	0.773	S	S	*	*				166.2	151.5	121	-156.4	-110.2	0	0	0	112.3
209	E	34.7	Very low	33.2	Very low	144 Å²	144	145.5 Å²	145.5	67%	0.673	78%	0.782	S	S	*	*			trans	-66.1	166.2	-161.2	-57.1	177.3	146.2	0	0	114.8
210	E	31.1	Very low	33.5	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	79%	0.793	S	S	*	*			cis	-170.2	160.6	47.6	-167	173	174.4	0	0	111.6
211	E	32.3	Very low	33.3	Very low	175 Å²	175	144.1 Å²	144.1	82%	0.818	80%	0.798	S	S	*	*			trans	-67.2	161.2	-171	-57.2	173.6	134.5	0	0	115.6
212	T	33.5	Very low	34.2	Very low	136 Å²	136	144 Å²	144	83%	0.834	80%	0.803	S	S	*	*				179.5	103.3	111.2	-55.4	0	0	0	0	110.8
213	D	31.4	Very low	33.9	Very low	161 Å²	161	142.7 Å²	142.7	86%	0.861	80%	0.799	S	S	*	*				43.8	140.2	128.3	-129.1	-4.9	0	0	0	124.1
214	G	32	Very low	33.9	Very low	73 Å²	73	144 Å²	144	75%	0.753	81%	0.805	S	S	*	*			trans	152.1	63.2	164.6	0	0	0	0	0	117.8
215	K	35.2	Very low	33.2	Very low	170 Å²	170	145 Å²	145	74%	0.739	80%	0.803	S	S	*	*			trans	-67	136.6	167.3	-86.7	174.9	173.7	170.6	0	112.9
216	Y	33.9	Very low	33.3	Very low	242 Å²	242	144.6 Å²	144.6	95%	0.949	80%	0.801	S	S	*	*			trans	-145.2	133.6	136.9	-80	-74	0	0	0	111
217	H	30.2	Very low	33.4	Very low	158 Å²	158	148.4 Å²	148.4	73%	0.731	81%	0.805	S	S	*	*			trans	-85.4	140.1	179.3	-81.6	-82.5	0	0	0	112.7
218	S	35.6	Very low	32.8	Very low	107 Å²	107	150.3 Å²	150.3	75%	0.748	81%	0.808	S	S	*	*			trans	26.4	145.6	138.5	-54.4	0	0	0	0	121.1
219	P	35.7	Very low	33.2	Very low	124 Å²	124	148.9 Å²	148.9	81%	0.805	81%	0.806	S	S	*	*				-150	174.2	54	37.7	-14.6	0	0	0	118.5
220	S	37	Very low	33.1	Very low	118 Å²	118	150 Å²	150	83%	0.825	81%	0.811	S	S	*	*			trans	-47.5	141.7	175.8	52.8	0	0	0	0	117.6
221	S	29	Very low	33.1	Very low	120 Å²	120	148.4 Å²	148.4	84%	0.839	80%	0.803	S	S	*	*			trans	-149.5	138.7	142.6	78.2	0	0	0	0	111.3
222	L	43.1	Very low	33.1	Very low	179 Å²	179	148.7 Å²	148.7	94%	0.937	81%	0.805	S	S	*	*			trans	-59.5	129.9	-177.9	-72.3	142.8	0	0	0	112.5
223	A	29.1	Very low	33.3	Very low	87 Å²	87	146 Å²	146	72%	0.719	80%	0.804	S	S	*	*			trans	-143.2	121.9	152.4	0	0	0	0	0	108.6	D225	A223-D225 PolarHBondContact O-N 3.35Å
224	T	38.6	Very low	33.8	Very low	149 Å²	149	141 Å²	141	91%	0.914	79%	0.785	S	S	*	*			trans	-38.4	113.2	158.1	27.4	0	0	0	0	110.4
225	D	26.2	Very low	34.9	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	77%	0.772	S	S	*	*			trans	-126.8	118	165.3	-137.3	-6	0	0	0	108.5	A223	A223-D225 PolarHBondContact O-N 3.35Å
226	D	29.8	Very low	37	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	75%	0.749	S	S	*	*			trans	-55.6	144.6	178.9	-85.9	-46.1	0	0	0	110	L228	D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 3.22Å
227	F	32.3	Very low	39.8	Very low	187 Å²	187	123 Å²	123	82%	0.82	71%	0.709	S	S	*	*			trans	-53.4	86.9	177.1	-83	-97.5	0	0	0	112.1	F229	F227-F229 VanDerWaalsContact C-N 3.28Å; F227-F229 HydrophobicContact CB-CD2 4.36Å; F227-F229 HydrophobicContact CD1-CD2 4.27Å; F227-F229 AromaticContact CD1-CE2 3.71Å; F227-F229 HydrophobicContact CD1-CE2 3.71Å; F227-F229 HydrophobicContact CD1-CZ 4.46Å; F227-F229 HydrophobicContact CE1-CE2 4.41Å; F227-F229 PolarHBondContact O-N 2.75Å
228	L	31.8	Very low	42.9	Very low	156 Å²	156	118.6 Å²	118.6	82%	0.817	69%	0.689	S	S	*	*			trans	-67	88.9	154.7	-84.3	161.2	0	0	0	107.7	D226 H230	D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 3.22Å; L228-H230 PolarHBondContact O-N 3.03Å
229	F	35.2	Very low	45.8	Very low	170 Å²	170	113.7 Å²	113.7	75%	0.746	65%	0.654	S	S	*	*			trans	-73.3	110.3	155	-88.5	-81.9	0	0	0	107.7	F227 Q231	F227-F229 VanDerWaalsContact C-N 3.28Å; F227-F229 HydrophobicContact CB-CD2 4.36Å; F227-F229 HydrophobicContact CD1-CD2 4.27Å; F227-F229 AromaticContact CD1-CE2 3.71Å; F227-F229 HydrophobicContact CD1-CE2 3.71Å; F227-F229 HydrophobicContact CD1-CZ 4.46Å; F227-F229 HydrophobicContact CE1-CE2 4.41Å; F227-F229 PolarHBondContact O-N 2.75Å; F229-Q231 PolarHBondContact O-N 3.46Å
230	H	32.9	Very low	48.7	Very low	168 Å²	168	108.7 Å²	108.7	78%	0.778	62%	0.621	S	S	*	*			trans	-46.4	110.8	160.6	-104.5	-62.3	0	0	0	109.6	L228	L228-H230 PolarHBondContact O-N 3.03Å
231	Q	30.1	Very low	51.5	Low	146 Å²	146	103.1 Å²	103.1	68%	0.682	58%	0.582	S	S	*	*			trans	-118.8	69.4	168.5	-163.5	170.7	27.7	0	0	108.3	F229 G233 A234	F229-Q231 PolarHBondContact O-N 3.46Å; Q231-G233 VanDerWaalsContact C-N 3.31Å; Q231-G233 PolarHBondContact O-N 3.5Å; Q231-A234 HydrophobicContact CG-CB 3.78Å; Q231-A234 VanDerWaalsContact NE2-CB 3.25Å
232	E	32.4	Very low	54.7	Low	182 Å²	182	101.3 Å²	101.3	85%	0.85	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	93.2	163.1	-78.6	-178.3	147	0	0	107.9
233	G	38.8	Very low	57	Low	80 Å²	80	93 Å²	93	83%	0.825	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	139.6	6.8	161.8	0	0	0	0	0	119.6	Q231	Q231-G233 VanDerWaalsContact C-N 3.31Å; Q231-G233 PolarHBondContact O-N 3.5Å
234	A	40.3	Very low	59.7	Low	55 Å²	55	91.4 Å²	91.4	46%	0.455	50%	0.501	S	S	.	.			trans	-133.1	117.3	-169.9	0	0	0	0	0	116	Q231	Q231-A234 HydrophobicContact CG-CB 3.78Å; Q231-A234 VanDerWaalsContact NE2-CB 3.25Å
235	G	55.9	Low	62	Low	46 Å²	46	89 Å²	89	47%	0.474	48%	0.476	S	S	.	.			trans	74.4	93.4	149.7	0	0	0	0	0	117.4	F237	G235-F237 PolarHBondContact O-N 3.11Å
236	S	79.4	Confident	64.8	Low	39 Å²	39	82.6 Å²	82.6	27%	0.273	44%	0.442	S	S	.	.	S	Bend	trans	-71.8	-13.2	170	61.1	0	0	0	0	114	E271 L272	S236-E271 WeakPolarHBondContact CB-OE1 3.29Å; S236-E271 CarbonylContact O-C 3.42Å; S236-E271 VanDerWaalsContact O-CA 3.26Å; S236-E271 WeakPolarHBondContact O-CA 3.34Å; S236-E271 WeakPolarHBondContact O-CG 3.3Å; S236-E271 PolarHBondContact OG-OE1 3.48Å; S236-L272 PolarHBondContact O-N 2.85Å
237	F	92.3	Very high	67.2	Low	21 Å²	21	78.9 Å²	78.9	9%	0.092	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140	-175.9	-65.7	-83.1	0	0	0	112.5	G235 Y239 S270 E271 V285 W348 V350 T384 H396	G235-F237 PolarHBondContact O-N 3.11Å; F237-Y239 HydrophobicContact CB-CE1 4.04Å; F237-Y239 WeakPolarHBondContact CB-OH 3.37Å; F237-S270 WeakPolarHBondContact CA-O 3.38Å; F237-E271 HydrophobicContact CD1-CB 4.27Å; F237-E271 HydrophobicContact CD1-CG 4.24Å; F237-E271 HydrophobicContact CE1-CB 4.24Å; F237-E271 HydrophobicContact CE1-CG 4.16Å; F237-E271 HydrophobicContact CZ-CG 4.45Å; F237-V285 HydrophobicContact CE1-CG2 4.48Å; F237-V285 HydrophobicContact CZ-CG1 4.27Å; F237-W348 AromaticContact CD1-CH2 3.91Å; F237-W348 HydrophobicContact CD1-CH2 3.91Å; F237-W348 AromaticContact CD1-CZ2 3.95Å; F237-W348 HydrophobicContact CD1-CZ2 3.95Å; F237-W348 AromaticContact CE1-CH2 3.96Å; F237-W348 HydrophobicContact CE1-CH2 3.96Å; F237-W348 AromaticContact CE1-CZ2 3.97Å; F237-W348 HydrophobicContact CE1-CZ2 3.97Å; F237-V350 HydrophobicContact CE1-CG1 4.02Å; F237-V350 HydrophobicContact CZ-CG1 4.42Å; F237-T384 HydrophobicContact CD1-CG2 4.36Å; F237-T384 HydrophobicContact CE1-CG2 4.03Å; F237-T384 HydrophobicContact CZ-CG2 4.14Å; F237-H396 HydrophobicContact CB-CB 4.3Å; F237-H396 HydrophobicContact CD2-CB 3.7Å; F237-H396 HydrophobicContact CE2-CB 4.47Å; F237-H396 HydrophobicContact CG-CB 4.29Å
238	Q	94.6	Very high	69.2	Low	67 Å²	67	76.4 Å²	76.4	31%	0.313	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.4	173.8	-178.5	173.7	79	0	0	110	S270 L272 F446	Q238-S270 PolarHBondContact N-O 3.2Å; Q238-S270 PolarHBondContact O-N 3.34Å; Q238-L272 HydrophobicContact CB-CD1 3.65Å; Q238-L272 HydrophobicContact CB-CG 4.01Å; Q238-L272 HydrophobicContact CG-CD1 4.25Å; Q238-F446 VanDerWaalsContact CD-CE1 3.48Å; Q238-F446 HydrophobicContact CG-CD1 3.93Å; Q238-F446 HydrophobicContact CG-CE1 4.17Å
239	Y	96.6	Very high	70.9	Confident	3 Å²	3	75.9 Å²	75.9	1%	0.012	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.9	174.9	-34.7	-64.2	0	0	0	110.5	F237 T268 L269 I382 T384 H396 A398 F447	F237-Y239 HydrophobicContact CB-CE1 4.04Å; F237-Y239 WeakPolarHBondContact CB-OH 3.37Å; Y239-T268 CarbonylContact C-O 3.52Å; Y239-T268 VanDerWaalsContact CA-O 3.22Å; Y239-T268 WeakPolarHBondContact CA-O 3.44Å; Y239-L269 HydrophobicContact CD1-CB 3.72Å; Y239-L269 HydrophobicContact CD1-CD2 3.82Å; Y239-L269 HydrophobicContact CD1-CG 3.61Å; Y239-L269 HydrophobicContact CE1-CB 4.18Å; Y239-L269 HydrophobicContact CE1-CD2 3.92Å; Y239-L269 HydrophobicContact CE1-CG 4.18Å; Y239-L269 HydrophobicContact CG-CG 4.49Å; Y239-I382 HydrophobicContact CD1-CG2 4.42Å; Y239-I382 HydrophobicContact CD2-CB 4.16Å; Y239-I382 HydrophobicContact CD2-CD1 4.24Å; Y239-I382 HydrophobicContact CD2-CG2 4.29Å; Y239-I382 HydrophobicContact CE1-CG2 4.22Å; Y239-I382 HydrophobicContact CE2-CB 4.17Å; Y239-I382 HydrophobicContact CE2-CG2 4.06Å; Y239-I382 HydrophobicContact CG-CD1 3.99Å; Y239-I382 HydrophobicContact CG-CG2 4.46Å; Y239-T384 WeakPolarHBondContact OH-CB 3.29Å; Y239-T384 PolarHBondContact OH-OG1 3.23Å; Y239-H396 AromaticContact CE2-CE1 3.54Å; Y239-H396 AromaticContact CE2-ND1 3.29Å; Y239-H396 VanDerWaalsContact CE2-ND1 3.29Å; Y239-H396 WeakPolarHBondContact CE2-ND1 3.47Å; Y239-H396 AromaticContact CZ-CE1 3.98Å; Y239-H396 AromaticContact CZ-ND1 3.38Å; Y239-H396 PolarHBondContact OH-ND1 3.11Å; Y239-A398 HydrophobicContact CD2-CB 3.61Å; Y239-A398 HydrophobicContact CE2-CB 3.62Å; Y239-F447 HydrophobicContact CD2-CB 4.2Å; Y239-F447 HydrophobicContact CD2-CG 4.47Å; Y239-F447 WeakPolarHBondContact O-CD2 3.1Å; Y239-F447 PolarHBondContact O-N 3.33Å
240	T	96.5	Very high	72.5	Confident	20 Å²	20	73.2 Å²	73.2	12%	0.123	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.8	178.3	65.9	0	0	0	0	111.7	V267 T268 V444 T445 F446	T240-V267 CarbonylContact O-C 3.58Å; T240-V267 WeakPolarHBondContact O-CA 3.27Å; T240-V267 WeakPolarHBondContact O-CG1 3.33Å; T240-T268 PolarHBondContact N-O 3.25Å; T240-T268 PolarHBondContact O-N 3.15Å; T240-T268 WeakPolarHBondContact OG1-CB 3.28Å; T240-V444 VanDerWaalsContact CB-CG1 3.44Å; T240-V444 HydrophobicContact CG2-CG1 3.83Å; T240-T445 CarbonylContact C-O 3.52Å; T240-T445 VanDerWaalsContact CA-O 3.28Å; T240-T445 WeakPolarHBondContact CA-O 3.48Å; T240-F446 HydrophobicContact CG2-CD1 3.46Å; T240-F446 VanDerWaalsContact CG2-CD1 3.46Å; T240-F446 HydrophobicContact CG2-CE1 3.42Å; T240-F446 VanDerWaalsContact CG2-CE1 3.42Å; T240-F446 HydrophobicContact CG2-CG 4.18Å; T240-F446 HydrophobicContact CG2-CZ 4.12Å
241	L	96.9	Very high	73.9	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.4	174.6	171.5	63.4	0	0	0	108.4	A243 T257 L259 V267 I380 I402 T445 F447	L241-A243 HydrophobicContact CD1-CB 4.48Å; L241-A243 HydrophobicContact CG-CB 4.09Å; L241-A243 PolarHBondContact O-N 3.3Å; L241-A243 VanDerWaalsContact O-N 3.1Å; L241-T257 HydrophobicContact CD2-CG2 3.8Å; L241-T257 HydrophobicContact CG-CG2 4.39Å; L241-L259 HydrophobicContact CD2-CD2 4.25Å; L241-V267 HydrophobicContact CD1-CG2 3.69Å; L241-I380 HydrophobicContact CD2-CD1 4.22Å; L241-I402 HydrophobicContact CD2-CG2 4.47Å; L241-T445 PolarHBondContact N-O 3.03Å; L241-T445 PolarHBondContact O-N 3.2Å; L241-F447 HydrophobicContact CB-CE2 3.71Å; L241-F447 HydrophobicContact CB-CZ 4.32Å
242	D	95.3	Very high	75.7	Confident	83 Å²	83	71.4 Å²	71.4	44%	0.444	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	84.5	177.3	-168.1	11.8	0	0	0	109.8	Y265 A266 D443	D242-Y265 WeakPolarHBondContact O-CD1 3.39Å; D242-A266 HydrophobicContact CB-CB 3.98Å; D242-A266 PolarHBondContact N-O 2.89Å; D242-D443 CarbonylContact C-O 3.5Å
243	A	92.6	Very high	77.8	Confident	5 Å²	5	67 Å²	67	4%	0.041	38%	0.379	C	S	.	.	S	Bend	trans	-160	144.5	177.6	0	0	0	0	0	110.1	L241 R245 T257 L259 Y265 D443 T445	L241-A243 HydrophobicContact CD1-CB 4.48Å; L241-A243 HydrophobicContact CG-CB 4.09Å; L241-A243 PolarHBondContact O-N 3.3Å; L241-A243 VanDerWaalsContact O-N 3.1Å; A243-R245 PolarHBondContact O-N 3.01Å; A243-T257 HydrophobicContact CB-CG2 3.49Å; A243-T257 VanDerWaalsContact CB-CG2 3.49Å; A243-L259 HydrophobicContact CB-CD2 3.5Å; A243-Y265 HydrophobicContact CB-CD1 3.54Å; A243-Y265 HydrophobicContact CB-CE1 3.8Å; A243-Y265 HydrophobicContact CB-CG 4.32Å; A243-D443 CarbonylContact C-O 3.53Å; A243-D443 PolarHBondContact N-O 2.76Å; A243-T445 PolarHBondContact O-OG1 3.19Å
244	T	84.8	Confident	79.7	Confident	52 Å²	52	63.7 Å²	63.7	32%	0.319	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-62.1	125	-175	-48.1	0	0	0	0	112	Y258 I414 D443	T244-Y258 PolarHBondContact O-N 3.27Å; T244-I414 VanDerWaalsContact CB-CD1 3.43Å; T244-I414 HydrophobicContact CG2-CD1 3.35Å; T244-I414 HydrophobicContact CG2-CG1 4.05Å; T244-I414 HydrophobicContact CG2-CG2 4.23Å; T244-D443 PolarHBondContact OG1-OD1 3.46Å
245	R	86.9	Confident	81.8	Confident	99 Å²	99	61.8 Å²	61.8	37%	0.374	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-81.3	147.5	-177.2	-171.4	-175.7	169	-175.5	4.1	111.7	A243 L247 M256	A243-R245 PolarHBondContact O-N 3.01Å; R245-L247 PolarHBondContact O-N 3.3Å; R245-M256 WeakPolarHBondContact CG-O 3.49Å
246	S	85.4	Confident	83.5	Confident	8 Å²	8	61.6 Å²	61.6	6%	0.056	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-54.5	135.6	166.8	169.3	0	0	0	0	111.5	R248 M256 Y258	S246-R248 PolarHBondContact O-N 3Å; S246-R248 PolarHBondContact OG-N 3.25Å; S246-R248 PolarHBondContact OG-O 3.18Å; S246-M256 VanDerWaalsContact CB-O 3.31Å; S246-M256 WeakPolarHBondContact CB-O 3.46Å; S246-M256 PolarHBondContact N-O 3.33Å; S246-Y258 PolarHBondContact OG-OH 3.34Å
247	L	81.1	Confident	84.3	Confident	69 Å²	69	59.7 Å²	59.7	36%	0.361	30%	0.302	S	S	.	.	S	Bend	trans	-76.9	-17.3	172.7	-67.5	168.4	0	0	0	111.6	R245 Q249 E417 E418 L421	R245-L247 PolarHBondContact O-N 3.3Å; L247-Q249 PolarHBondContact O-N 3.03Å; L247-E417 HydrophobicContact CD1-CB 4.34Å; L247-E417 PolarHBondContact N-OE2 3.42Å; L247-E418 HydrophobicContact CD1-CB 4.42Å; L247-E418 HydrophobicContact CD1-CG 3.44Å; L247-E418 VanDerWaalsContact CD1-CG 3.44Å; L247-L421 HydrophobicContact CB-CD1 3.61Å; L247-L421 HydrophobicContact CD1-CD1 3.65Å; L247-L421 HydrophobicContact CG-CD1 4.2Å
248	R	73.9	Confident	84.4	Confident	135 Å²	135	59.4 Å²	59.4	51%	0.509	30%	0.3	S	S	.	.			trans	-84	108.5	172.7	-66.4	176.4	179.7	-105.1	-3.5	109.2	S246 E417	S246-R248 PolarHBondContact O-N 3Å; S246-R248 PolarHBondContact OG-N 3.25Å; S246-R248 PolarHBondContact OG-O 3.18Å; R248-E417 IonicContact NE-OE1 3.7Å
249	Q	67.2	Low	84.6	Confident	145 Å²	145	56.3 Å²	56.3	68%	0.678	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-90.2	116.9	158.7	-75.2	175	0.9	0	0	107.9	L247	L247-Q249 PolarHBondContact O-N 3.03Å
250	K	68.9	Low	84.6	Confident	115 Å²	115	56.3 Å²	56.3	50%	0.5	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-89.1	133.6	164.3	-79.2	169	158.2	-166.7	0	108	G252 E253	K250-G252 PolarHBondContact O-N 3.3Å; K250-E253 HydrophobicContact CB-CB 4.22Å; K250-E253 HydrophobicContact CB-CG 4.47Å; K250-E253 VanDerWaalsContact CD-CD 3.43Å; K250-E253 WeakPolarHBondContact CD-OE1 3.42Å; K250-E253 WeakPolarHBondContact CD-OE2 3.24Å; K250-E253 IonicContact NZ-OE1 3.33Å; K250-E253 PolarHBondContact NZ-OE1 3.27Å; K250-E253 IonicContact NZ-OE2 3.97Å; K250-E253 PolarHBondContact NZ-OE2 3.17Å; K250-E253 VanDerWaalsContact NZ-OE2 3.14Å; K250-E253 PolarHBondContact O-N 3.42Å
251	Q	62.3	Low	84.6	Confident	204 Å²	204	59.2 Å²	59.2	95%	0.953	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	130.5	177	-157.5	168.7	19.8	0	0	109.3	E253	Q251-E253 PolarHBondContact O-N 3.48Å
252	G	68.1	Low	84.5	Confident	71 Å²	71	61.2 Å²	61.2	73%	0.732	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-25.5	-179.8	0	0	0	0	0	116.1	K250	K250-G252 PolarHBondContact O-N 3.3Å
253	E	76	Confident	84.6	Confident	90 Å²	90	60.4 Å²	60.4	42%	0.421	31%	0.311	S	S	.	.	S	Bend	trans	-83	151.6	176	-75.4	177.8	-157.8	0	0	111.4	K250 Q251	K250-E253 HydrophobicContact CB-CB 4.22Å; K250-E253 HydrophobicContact CB-CG 4.47Å; K250-E253 VanDerWaalsContact CD-CD 3.43Å; K250-E253 WeakPolarHBondContact CD-OE1 3.42Å; K250-E253 WeakPolarHBondContact CD-OE2 3.24Å; K250-E253 IonicContact NZ-OE1 3.33Å; K250-E253 PolarHBondContact NZ-OE1 3.27Å; K250-E253 IonicContact NZ-OE2 3.97Å; K250-E253 PolarHBondContact NZ-OE2 3.17Å; K250-E253 VanDerWaalsContact NZ-OE2 3.14Å; K250-E253 PolarHBondContact O-N 3.42Å; Q251-E253 PolarHBondContact O-N 3.48Å
254	G	77.8	Confident	84.8	Confident	10 Å²	10	63.8 Å²	63.8	10%	0.103	33%	0.325	C	S	.	.			trans	-66	175.2	176.2	0	0	0	0	0	113.2	M256	G254-M256 PolarHBondContact O-N 2.59Å
255	P	85.6	Confident	85.4	Confident	15 Å²	15	62.2 Å²	62.2	10%	0.097	31%	0.313	C	S	.	.			trans	-64.5	123.5	176.2	27.1	-31.7	0	0	0	110.2	S400 Q401 T445 F446	P255-S400 PolarHBondContact O-OG 2.98Å; P255-Q401 WeakPolarHBondContact O-CB 3.43Å; P255-Q401 PolarHBondContact O-N 3.29Å; P255-T445 HydrophobicContact CB-CG2 3.64Å; P255-T445 HydrophobicContact CG-CG2 4.17Å; P255-F446 VanDerWaalsContact CG-O 3.3Å; P255-F446 WeakPolarHBondContact CG-O 3.41Å
256	M	92.1	Very high	85.9	Confident	42 Å²	42	58 Å²	58	21%	0.207	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.9	178.1	176.6	64.3	63.9	0	0	111.2	R245 S246 G254 Y258 Q401 K403	R245-M256 WeakPolarHBondContact CG-O 3.49Å; S246-M256 VanDerWaalsContact CB-O 3.31Å; S246-M256 WeakPolarHBondContact CB-O 3.46Å; S246-M256 PolarHBondContact N-O 3.33Å; G254-M256 PolarHBondContact O-N 2.59Å; M256-Y258 HydrophobicContact CG-CD1 4.26Å; M256-Y258 HydrophobicContact CG-CE1 3.68Å; M256-Y258 HydrophobicContact SD-CD1 4.49Å; M256-Y258 HydrophobicContact SD-CE1 4.17Å; M256-Q401 CarbonylContact C-O 3.53Å; M256-Q401 WeakPolarHBondContact CA-O 3.41Å; M256-Q401 HydrophobicContact CE-CB 3.74Å; M256-Q401 HydrophobicContact SD-CB 4.22Å; M256-K403 HydrophobicContact SD-CB 4.08Å
257	T	94.8	Very high	86.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.5	-178.5	-57.4	0	0	0	0	111	L241 A243 L259 Q401 I402 K403 T445	L241-T257 HydrophobicContact CD2-CG2 3.8Å; L241-T257 HydrophobicContact CG-CG2 4.39Å; A243-T257 HydrophobicContact CB-CG2 3.49Å; A243-T257 VanDerWaalsContact CB-CG2 3.49Å; T257-L259 HydrophobicContact CG2-CD2 3.99Å; T257-Q401 PolarHBondContact N-O 2.78Å; T257-I402 CarbonylContact O-C 3.53Å; T257-I402 VanDerWaalsContact O-CA 3.31Å; T257-I402 WeakPolarHBondContact O-CA 3.47Å; T257-K403 PolarHBondContact O-N 3.15Å; T257-T445 WeakPolarHBondContact OG1-CB 3.45Å; T257-T445 WeakPolarHBondContact OG1-CG2 3.24Å; T257-T445 PolarHBondContact OG1-OG1 2.71Å
258	Y	95.6	Very high	87.2	Confident	15 Å²	15	55.2 Å²	55.2	6%	0.059	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.3	-177.6	-60.6	-30.8	0	0	0	110.2	T244 S246 M256 K403 F405 K413 I414 E417	T244-Y258 PolarHBondContact O-N 3.27Å; S246-Y258 PolarHBondContact OG-OH 3.34Å; M256-Y258 HydrophobicContact CG-CD1 4.26Å; M256-Y258 HydrophobicContact CG-CE1 3.68Å; M256-Y258 HydrophobicContact SD-CD1 4.49Å; M256-Y258 HydrophobicContact SD-CE1 4.17Å; Y258-K403 WeakPolarHBondContact CA-O 3.37Å; Y258-K403 HydrophobicContact CD1-CB 3.83Å; Y258-K403 HydrophobicContact CE1-CB 4.1Å; Y258-F405 AromaticContact CD1-CE2 3.78Å; Y258-F405 HydrophobicContact CD1-CE2 3.78Å; Y258-F405 HydrophobicContact CD1-CZ 4.35Å; Y258-F405 HydrophobicContact CE1-CE2 4.45Å; Y258-F405 AromaticContact CG-CE2 3.88Å; Y258-F405 HydrophobicContact CG-CE2 3.88Å; Y258-K413 HydrophobicContact CD2-CB 4.28Å; Y258-K413 HydrophobicContact CD2-CG 3.88Å; Y258-K413 HydrophobicContact CE1-CG 4.49Å; Y258-K413 HydrophobicContact CE2-CB 4.33Å; Y258-K413 HydrophobicContact CE2-CG 3.49Å; Y258-K413 VanDerWaalsContact CE2-CG 3.49Å; Y258-I414 HydrophobicContact CD2-CD1 4.36Å; Y258-I414 HydrophobicContact CD2-CG1 3.76Å; Y258-I414 HydrophobicContact CE2-CG1 4.38Å; Y258-E417 PolarHBondContact OH-OE1 2.77Å
259	L	97.3	Very high	88.3	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	153.3	-177.6	-54.2	-177.2	0	0	0	110.3	L241 A243 T257 Y265 V360 I380 I402 K403 V404 F405	L241-L259 HydrophobicContact CD2-CD2 4.25Å; A243-L259 HydrophobicContact CB-CD2 3.5Å; T257-L259 HydrophobicContact CG2-CD2 3.99Å; L259-Y265 HydrophobicContact CB-CD2 4.39Å; L259-Y265 HydrophobicContact CB-CE2 3.78Å; L259-Y265 HydrophobicContact CD2-CD1 4Å; L259-Y265 HydrophobicContact CD2-CD2 3.76Å; L259-Y265 HydrophobicContact CD2-CE1 3.97Å; L259-Y265 HydrophobicContact CD2-CE2 3.75Å; L259-Y265 HydrophobicContact CD2-CG 3.87Å; L259-Y265 HydrophobicContact CG-CD2 4.44Å; L259-Y265 HydrophobicContact CG-CE2 4.26Å; L259-V360 HydrophobicContact CD1-CG2 4.13Å; L259-I380 HydrophobicContact CD1-CD1 4.06Å; L259-I402 HydrophobicContact CD1-CB 4.18Å; L259-I402 HydrophobicContact CD1-CD1 4.16Å; L259-I402 HydrophobicContact CD1-CG2 3.86Å; L259-I402 HydrophobicContact CG-CG2 4.35Å; L259-K403 PolarHBondContact N-O 3.35Å; L259-V404 HydrophobicContact CB-CG2 4.48Å; L259-V404 CarbonylContact O-C 3.53Å; L259-V404 WeakPolarHBondContact O-CA 3.48Å; L259-F405 PolarHBondContact O-N 3.49Å
260	N	97.6	Very high	89.6	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.5	171.1	-65.5	-41.3	0	0	0	109.4	G262 Q263 Y265 F405 D407 G409 A410 E411	N260-G262 PolarHBondContact O-N 3.47Å; N260-Q263 HydrophobicContact CB-CB 4.02Å; N260-Q263 PolarHBondContact ND2-OE1 2.89Å; N260-Q263 VanDerWaalsContact ND2-OE1 3.11Å; N260-Q263 WeakPolarHBondContact O-CB 3.28Å; N260-Q263 PolarHBondContact O-N 3.49Å; N260-Y265 PolarHBondContact N-OH 3.39Å; N260-F405 CarbonylContact C-O 3.54Å; N260-F405 WeakPolarHBondContact CA-O 3.45Å; N260-D407 VanDerWaalsContact CB-O 3.3Å; N260-D407 WeakPolarHBondContact CB-O 3.28Å; N260-D407 PolarHBondContact OD1-O 2.79Å; N260-G409 PolarHBondContact OD1-N 2.88Å; N260-A410 VanDerWaalsContact OD1-CB 3.22Å; N260-A410 WeakPolarHBondContact OD1-CB 3.4Å; N260-A410 PolarHBondContact OD1-N 2.93Å; N260-E411 VanDerWaalsContact ND2-CD 3.31Å; N260-E411 PolarHBondContact ND2-OE1 2.91Å; N260-E411 PolarHBondContact ND2-OE2 2.94Å
261	K	97.5	Very high	90.6	Very high	81 Å²	81	38.9 Å²	38.9	35%	0.352	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	131.2	178.3	178.4	178.9	168.2	169.5	0	110.7	Q263 V360 N361 L363 V404 F405	K261-Q263 PolarHBondContact O-N 3.49Å; K261-V360 WeakPolarHBondContact CA-O 3.47Å; K261-N361 WeakPolarHBondContact CD-O 3.34Å; K261-N361 WeakPolarHBondContact CE-O 3.4Å; K261-N361 PolarHBondContact NZ-O 3.38Å; K261-L363 HydrophobicContact CB-CD2 3.71Å; K261-L363 HydrophobicContact CD-CD2 3.84Å; K261-L363 HydrophobicContact CD-CG 4.15Å; K261-L363 HydrophobicContact CG-CD2 4.32Å; K261-V404 HydrophobicContact CB-CG1 4.12Å; K261-F405 PolarHBondContact N-O 3Å
262	G	94.1	Very high	91.5	Very high	42 Å²	42	34 Å²	34	43%	0.433	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	-1.2	178.2	0	0	0	0	0	114.8	N260 T359 V360	N260-G262 PolarHBondContact O-N 3.47Å; G262-T359 WeakPolarHBondContact CA-OG1 3.34Å; G262-T359 PolarHBondContact N-OG1 2.87Å; G262-V360 PolarHBondContact N-O 3.34Å
263	Q	97.1	Very high	91.6	Very high	66 Å²	66	32 Å²	32	31%	0.308	17%	0.173	S	C	.	.			trans	-85.9	137.2	170.6	-175.5	172.1	-25.2	0	0	109.4	N260 K261 Y265 T359	N260-Q263 HydrophobicContact CB-CB 4.02Å; N260-Q263 PolarHBondContact ND2-OE1 2.89Å; N260-Q263 VanDerWaalsContact ND2-OE1 3.11Å; N260-Q263 WeakPolarHBondContact O-CB 3.28Å; N260-Q263 PolarHBondContact O-N 3.49Å; K261-Q263 PolarHBondContact O-N 3.49Å; Q263-Y265 HydrophobicContact CB-CE2 3.87Å; Q263-Y265 HydrophobicContact CG-CE1 4.46Å; Q263-Y265 HydrophobicContact CG-CE2 4.04Å; Q263-Y265 VanDerWaalsContact O-CD2 3.31Å; Q263-Y265 WeakPolarHBondContact O-CD2 3.41Å; Q263-Y265 WeakPolarHBondContact O-CE2 3.44Å; Q263-T359 PolarHBondContact N-OG1 2.86Å; Q263-T359 VanDerWaalsContact O-CB 3.23Å; Q263-T359 WeakPolarHBondContact O-CB 3.36Å; Q263-T359 PolarHBondContact O-OG1 2.9Å
264	F	97.3	Very high	90.6	Very high	76 Å²	76	32.6 Å²	32.6	33%	0.333	19%	0.193	S	C	.	.			trans	-84.7	137.4	175.4	-73.7	-80.4	0	0	0	111.3	A324 F357 I358 T359	F264-A324 HydrophobicContact CD1-CB 3.66Å; F264-A324 HydrophobicContact CE1-CB 3.6Å; F264-A324 HydrophobicContact CG-CB 4.15Å; F264-A324 HydrophobicContact CZ-CB 4.05Å; F264-F357 HydrophobicContact CB-CB 4.42Å; F264-F357 HydrophobicContact CD1-CB 4.44Å; F264-I358 CarbonylContact C-O 3.54Å; F264-I358 WeakPolarHBondContact CA-O 3.34Å; F264-T359 HydrophobicContact CD1-CG2 4.13Å; F264-T359 HydrophobicContact CE1-CG2 3.63Å; F264-T359 HydrophobicContact CE2-CG2 4.4Å; F264-T359 HydrophobicContact CZ-CG2 3.79Å
265	Y	97.2	Very high	89.4	Confident	19 Å²	19	36.6 Å²	36.6	8%	0.075	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.8	178.5	-64.3	-82.3	0	0	0	109.8	D242 A243 L259 N260 Q263 F357 I358	D242-Y265 WeakPolarHBondContact O-CD1 3.39Å; A243-Y265 HydrophobicContact CB-CD1 3.54Å; A243-Y265 HydrophobicContact CB-CE1 3.8Å; A243-Y265 HydrophobicContact CB-CG 4.32Å; L259-Y265 HydrophobicContact CB-CD2 4.39Å; L259-Y265 HydrophobicContact CB-CE2 3.78Å; L259-Y265 HydrophobicContact CD2-CD1 4Å; L259-Y265 HydrophobicContact CD2-CD2 3.76Å; L259-Y265 HydrophobicContact CD2-CE1 3.97Å; L259-Y265 HydrophobicContact CD2-CE2 3.75Å; L259-Y265 HydrophobicContact CD2-CG 3.87Å; L259-Y265 HydrophobicContact CG-CD2 4.44Å; L259-Y265 HydrophobicContact CG-CE2 4.26Å; N260-Y265 PolarHBondContact N-OH 3.39Å; Q263-Y265 HydrophobicContact CB-CE2 3.87Å; Q263-Y265 HydrophobicContact CG-CE1 4.46Å; Q263-Y265 HydrophobicContact CG-CE2 4.04Å; Q263-Y265 VanDerWaalsContact O-CD2 3.31Å; Q263-Y265 WeakPolarHBondContact O-CD2 3.41Å; Q263-Y265 WeakPolarHBondContact O-CE2 3.44Å; Y265-F357 WeakPolarHBondContact O-CA 3.47Å; Y265-I358 PolarHBondContact N-O 3.36Å; Y265-I358 PolarHBondContact O-N 3.22Å
266	A	96.4	Very high	88	Confident	10 Å²	10	41.2 Å²	41.2	8%	0.083	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.5	178.6	0	0	0	0	0	110.2	D242 I356 F357	D242-A266 HydrophobicContact CB-CB 3.98Å; D242-A266 PolarHBondContact N-O 2.89Å; A266-I356 CarbonylContact C-O 3.48Å; A266-I356 WeakPolarHBondContact CA-O 3.32Å; A266-F357 HydrophobicContact CB-CD1 3.88Å; A266-F357 HydrophobicContact CB-CE1 3.7Å; A266-F357 HydrophobicContact CB-CZ 4.35Å
267	V	97.5	Very high	85.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125	169.2	175.1	0	0	0	0	107.9	T240 L241 L269 I289 K355 I356 I358 I382	T240-V267 CarbonylContact O-C 3.58Å; T240-V267 WeakPolarHBondContact O-CA 3.27Å; T240-V267 WeakPolarHBondContact O-CG1 3.33Å; L241-V267 HydrophobicContact CD1-CG2 3.69Å; V267-L269 HydrophobicContact CG1-CD1 4.04Å; V267-I289 HydrophobicContact CG1-CD1 4.21Å; V267-I289 HydrophobicContact CG2-CD1 4.27Å; V267-K355 WeakPolarHBondContact O-CA 3.42Å; V267-I356 HydrophobicContact CB-CD1 4.29Å; V267-I356 HydrophobicContact CB-CG1 3.75Å; V267-I356 HydrophobicContact CG1-CD1 4.46Å; V267-I356 HydrophobicContact CG1-CG1 4.31Å; V267-I356 PolarHBondContact N-O 3.2Å; V267-I356 PolarHBondContact O-N 2.88Å; V267-I358 HydrophobicContact CG2-CD1 3.86Å; V267-I358 HydrophobicContact CG2-CG1 3.8Å; V267-I382 HydrophobicContact CG1-CD1 3.92Å
268	T	96.5	Very high	83.6	Confident	19 Å²	19	57.6 Å²	57.6	12%	0.117	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.2	178.6	-77.8	0	0	0	0	109.3	Y239 T240 E353 A354	Y239-T268 CarbonylContact C-O 3.52Å; Y239-T268 VanDerWaalsContact CA-O 3.22Å; Y239-T268 WeakPolarHBondContact CA-O 3.44Å; T240-T268 PolarHBondContact N-O 3.25Å; T240-T268 PolarHBondContact O-N 3.15Å; T240-T268 WeakPolarHBondContact OG1-CB 3.28Å; T268-E353 HydrophobicContact CG2-CG 3.39Å; T268-E353 WeakPolarHBondContact CG2-OE1 3.49Å; T268-E353 PolarHBondContact OG1-OE1 2.98Å; T268-A354 CarbonylContact C-O 3.56Å; T268-A354 WeakPolarHBondContact CA-O 3.36Å
269	L	96.8	Very high	81.6	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.6	174.8	-54.5	81.6	0	0	0	109.3	Y239 V267 F346 W348 A354 I356 I382	Y239-L269 HydrophobicContact CD1-CB 3.72Å; Y239-L269 HydrophobicContact CD1-CD2 3.82Å; Y239-L269 HydrophobicContact CD1-CG 3.61Å; Y239-L269 HydrophobicContact CE1-CB 4.18Å; Y239-L269 HydrophobicContact CE1-CD2 3.92Å; Y239-L269 HydrophobicContact CE1-CG 4.18Å; Y239-L269 HydrophobicContact CG-CG 4.49Å; V267-L269 HydrophobicContact CG1-CD1 4.04Å; L269-F346 HydrophobicContact CD1-CE2 4.27Å; L269-F346 HydrophobicContact CD1-CZ 3.95Å; L269-F346 HydrophobicContact CD2-CE2 4.2Å; L269-F346 HydrophobicContact CD2-CZ 3.89Å; L269-W348 HydrophobicContact CB-CH2 4.2Å; L269-W348 HydrophobicContact CB-CZ2 3.93Å; L269-W348 HydrophobicContact CD2-CZ2 4.42Å; L269-A354 HydrophobicContact CB-CB 4.23Å; L269-A354 HydrophobicContact CD1-CB 4.45Å; L269-A354 PolarHBondContact N-O 2.82Å; L269-A354 PolarHBondContact O-N 3.14Å; L269-I356 HydrophobicContact CD1-CD1 4.47Å; L269-I356 HydrophobicContact CD1-CG1 4.49Å; L269-I382 HydrophobicContact CD2-CG2 4.01Å
270	S	94.3	Very high	79.2	Confident	19 Å²	19	74.1 Å²	74.1	13%	0.133	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157	179.4	63.2	0	0	0	0	111.8	F237 Q238	F237-S270 WeakPolarHBondContact CA-O 3.38Å; Q238-S270 PolarHBondContact N-O 3.2Å; Q238-S270 PolarHBondContact O-N 3.34Å
271	E	90.3	Very high	77.2	Confident	31 Å²	31	80.2 Å²	80.2	15%	0.145	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.7	168.4	-159.5	-168.2	167.3	0	0	110.3	S236 F237 S273 K276 V350	S236-E271 WeakPolarHBondContact CB-OE1 3.29Å; S236-E271 CarbonylContact O-C 3.42Å; S236-E271 VanDerWaalsContact O-CA 3.26Å; S236-E271 WeakPolarHBondContact O-CA 3.34Å; S236-E271 WeakPolarHBondContact O-CG 3.3Å; S236-E271 PolarHBondContact OG-OE1 3.48Å; F237-E271 HydrophobicContact CD1-CB 4.27Å; F237-E271 HydrophobicContact CD1-CG 4.24Å; F237-E271 HydrophobicContact CE1-CB 4.24Å; F237-E271 HydrophobicContact CE1-CG 4.16Å; F237-E271 HydrophobicContact CZ-CG 4.45Å; E271-S273 VanDerWaalsContact CD-OG 3.29Å; E271-S273 WeakPolarHBondContact OE1-CB 3.44Å; E271-S273 PolarHBondContact OE1-OG 3.05Å; E271-K276 WeakPolarHBondContact O-CE 3.39Å; E271-K276 PolarHBondContact O-NZ 3.01Å; E271-V350 HydrophobicContact CB-CB 4.09Å; E271-V350 VanDerWaalsContact OE2-CB 3.29Å; E271-V350 WeakPolarHBondContact OE2-CB 3.36Å; E271-V350 WeakPolarHBondContact OE2-CG2 3.24Å
272	L	81.3	Confident	75.5	Confident	101 Å²	101	80.9 Å²	80.9	53%	0.529	42%	0.415	S	S	.	.			trans	-91.6	3.4	-179.3	-66.1	175.3	0	0	0	113.7	S236 Q238 A274	S236-L272 PolarHBondContact O-N 2.85Å; Q238-L272 HydrophobicContact CB-CD1 3.65Å; Q238-L272 HydrophobicContact CB-CG 4.01Å; Q238-L272 HydrophobicContact CG-CD1 4.25Å; L272-A274 PolarHBondContact O-N 3.16Å
273	S	70.7	Confident	75	Confident	29 Å²	29	80.4 Å²	80.4	20%	0.203	41%	0.405	C	S	.	.			trans	-61.5	130.1	-175.9	63.4	0	0	0	0	112	E271 N275 K276	E271-S273 VanDerWaalsContact CD-OG 3.29Å; E271-S273 WeakPolarHBondContact OE1-CB 3.44Å; E271-S273 PolarHBondContact OE1-OG 3.05Å; S273-N275 PolarHBondContact O-N 2.8Å; S273-K276 VanDerWaalsContact O-CG 3.28Å; S273-K276 WeakPolarHBondContact O-CG 3.29Å
274	A	55	Low	74.6	Confident	103 Å²	103	82.3 Å²	82.3	85%	0.851	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.2	-179.3	0	0	0	0	0	113.9	L272	L272-A274 PolarHBondContact O-N 3.16Å
275	N	53.4	Low	74.4	Confident	94 Å²	94	79.2 Å²	79.2	50%	0.503	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	32.8	-174.8	-67.1	-33.8	0	0	0	113.7	S273 R277 L278	S273-N275 PolarHBondContact O-N 2.8Å; N275-R277 PolarHBondContact O-N 2.82Å; N275-L278 PolarHBondContact O-N 3.04Å
276	K	56.4	Low	74.3	Confident	113 Å²	113	81 Å²	81	49%	0.491	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-17.4	176.6	-57.2	-162.7	177.2	-160.6	0	114.4	E271 S273	E271-K276 WeakPolarHBondContact O-CE 3.39Å; E271-K276 PolarHBondContact O-NZ 3.01Å; S273-K276 VanDerWaalsContact O-CG 3.28Å; S273-K276 WeakPolarHBondContact O-CG 3.29Å
277	R	47.7	Very low	74.3	Confident	243 Å²	243	80.6 Å²	80.6	92%	0.917	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-1	-174.4	-62.1	-163.3	177.5	-153.5	0.5	115.5	N275	N275-R277 PolarHBondContact O-N 2.82Å
278	L	46.6	Very low	74.3	Confident	142 Å²	142	80.9 Å²	80.9	74%	0.743	40%	0.404	S	S	*	.	S	Bend	trans	-127.1	9	-169	-86.6	155.7	0	0	0	115.8	N275	N275-L278 PolarHBondContact O-N 3.04Å
279	R	53.6	Low	74.4	Confident	204 Å²	204	80 Å²	80	77%	0.77	40%	0.399	S	S	*	.			trans	-116.8	120	176.2	-64.3	-138.4	-141.8	-123.4	10.3	113.3
280	H	46.2	Very low	74.5	Confident	160 Å²	160	80 Å²	80	74%	0.741	40%	0.399	S	S	*	.			trans	28.6	148.1	135.1	-60.9	73.6	0	0	0	120.1	I282	H280-I282 PolarHBondContact O-N 3.1Å
281	P	55	Low	74.7	Confident	131 Å²	131	79.1 Å²	79.1	85%	0.851	39%	0.393	S	S	*	.	S	Bend	trans	-65.3	10.8	-168.3	26.1	-36.1	0	0	0	118
282	I	62.6	Low	75	Confident	96 Å²	96	77.9 Å²	77.9	49%	0.492	39%	0.388	S	S	.	.			trans	-112.4	87.4	-175.1	-52.3	168.4	0	0	0	108.7	H280 N388	H280-I282 PolarHBondContact O-N 3.1Å; I282-N388 VanDerWaalsContact CD1-ND2 3.28Å; I282-N388 WeakPolarHBondContact CD1-ND2 3.21Å; I282-N388 WeakPolarHBondContact CG1-ND2 3.47Å
283	S	82.1	Confident	75.7	Confident	32 Å²	32	73.7 Å²	73.7	22%	0.224	37%	0.365	C	S	.	.			trans	-94.6	-10.2	178.3	60.9	0	0	0	0	113.8	D349 V350 N351	S283-D349 VanDerWaalsContact CB-OD1 3.3Å; S283-D349 WeakPolarHBondContact CB-OD1 3.24Å; S283-D349 VanDerWaalsContact CB-OD2 3.3Å; S283-D349 WeakPolarHBondContact CB-OD2 3.43Å; S283-D349 WeakPolarHBondContact O-CA 3.01Å; S283-D349 PolarHBondContact OG-OD2 3.15Å; S283-V350 WeakPolarHBondContact O-CG2 3.4Å; S283-V350 PolarHBondContact O-N 3.31Å; S283-N351 VanDerWaalsContact CB-ND2 3.3Å; S283-N351 WeakPolarHBondContact CB-ND2 3.37Å
284	K	89.4	Confident	76.6	Confident	105 Å²	105	74 Å²	74	46%	0.457	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.9	-175.7	-67.6	-168.9	176.6	-169.8	0	112.6	W348 Y387	K284-W348 WeakPolarHBondContact CA-O 3.34Å; K284-Y387 HydrophobicContact CB-CD1 4.4Å; K284-Y387 HydrophobicContact CB-CG 4.27Å; K284-Y387 WeakPolarHBondContact O-CB 3.41Å
285	V	93.3	Very high	77.9	Confident	11 Å²	11	73.3 Å²	73.3	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	160.8	171.7	-67.1	0	0	0	0	110.1	F237 T347 W348 V350 T384 Y385	F237-V285 HydrophobicContact CE1-CG2 4.48Å; F237-V285 HydrophobicContact CZ-CG1 4.27Å; V285-T347 CarbonylContact O-C 3.58Å; V285-T347 WeakPolarHBondContact O-CA 3.37Å; V285-T347 WeakPolarHBondContact O-CB 3.49Å; V285-W348 HydrophobicContact CG2-CD2 3.82Å; V285-W348 HydrophobicContact CG2-CG 4.13Å; V285-W348 HydrophobicContact CG2-CH2 4.39Å; V285-W348 HydrophobicContact CG2-CZ2 3.69Å; V285-W348 PolarHBondContact N-O 2.83Å; V285-W348 PolarHBondContact O-N 2.86Å; V285-V350 HydrophobicContact CB-CG1 4.3Å; V285-V350 HydrophobicContact CG1-CG1 3.64Å; V285-V350 HydrophobicContact CG2-CG1 3.68Å; V285-T384 HydrophobicContact CB-CG2 3.99Å; V285-T384 HydrophobicContact CG2-CG2 4.07Å; V285-Y385 WeakPolarHBondContact CB-O 3.47Å
286	R	94.8	Very high	78.9	Confident	58 Å²	58	77.1 Å²	77.1	22%	0.219	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.3	174.2	-175.2	177.5	66.1	85.5	1.7	109	V288 S345 F346 T347 T384 Y385	R286-V288 VanDerWaalsContact NH1-CG2 3.32Å; R286-S345 PolarHBondContact NH1-OG 3.47Å; R286-F346 CarbonylContact C-O 3.55Å; R286-F346 WeakPolarHBondContact CA-O 3.16Å; R286-T347 HydrophobicContact CB-CG2 4.13Å; R286-T347 HydrophobicContact CG-CG2 4.17Å; R286-T384 CarbonylContact O-C 3.58Å; R286-T384 WeakPolarHBondContact O-CA 3.19Å; R286-Y385 PolarHBondContact N-O 2.82Å; R286-Y385 PolarHBondContact O-N 2.9Å
287	S	97.2	Very high	80.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	142.6	175.3	-65.3	0	0	0	0	110.9	S345 F346 W348 D383 T384	S287-S345 CarbonylContact O-C 3.6Å; S287-S345 WeakPolarHBondContact O-CA 3.48Å; S287-F346 PolarHBondContact N-O 3.35Å; S287-F346 PolarHBondContact O-N 2.94Å; S287-W348 PolarHBondContact OG-NE1 3.12Å; S287-D383 CarbonylContact C-O 3.57Å; S287-D383 VanDerWaalsContact CA-O 3.27Å; S287-D383 WeakPolarHBondContact CA-O 3.18Å; S287-T384 PolarHBondContact OG-OG1 3.16Å
288	V	97.9	Very high	82.4	Confident	6 Å²	6	67.6 Å²	67.6	4%	0.036	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115	173.9	-178.6	0	0	0	0	107.8	R286 I339 A343 I344 I382 D383 Y385	R286-V288 VanDerWaalsContact NH1-CG2 3.32Å; V288-I339 HydrophobicContact CG1-CD1 3.67Å; V288-I339 HydrophobicContact CG2-CD1 4.27Å; V288-A343 HydrophobicContact CG1-CB 4.24Å; V288-I344 CarbonylContact C-O 3.56Å; V288-I344 WeakPolarHBondContact CA-O 3.39Å; V288-I382 WeakPolarHBondContact O-CA 3.49Å; V288-D383 PolarHBondContact N-O 3Å; V288-D383 PolarHBondContact O-N 3.3Å; V288-Y385 HydrophobicContact CB-CE2 4.47Å; V288-Y385 HydrophobicContact CG2-CD2 4.37Å; V288-Y385 HydrophobicContact CG2-CE2 3.94Å
289	I	98.6	Very high	84.6	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.4	172.2	-172.8	159.7	0	0	0	109.5	V267 L321 A343 I344 F346 I356 I358 I380 I382	V267-I289 HydrophobicContact CG1-CD1 4.21Å; V267-I289 HydrophobicContact CG2-CD1 4.27Å; I289-L321 HydrophobicContact CG1-CD2 4.36Å; I289-L321 HydrophobicContact CG2-CD2 4.11Å; I289-L321 WeakPolarHBondContact O-CD2 3.28Å; I289-A343 CarbonylContact O-C 3.55Å; I289-A343 VanDerWaalsContact O-CA 3.28Å; I289-A343 WeakPolarHBondContact O-CA 3.35Å; I289-I344 HydrophobicContact CG2-CB 4.01Å; I289-I344 PolarHBondContact N-O 2.88Å; I289-I344 PolarHBondContact O-N 3.26Å; I289-F346 HydrophobicContact CB-CE1 4.41Å; I289-F346 HydrophobicContact CG2-CE1 3.92Å; I289-I356 HydrophobicContact CD1-CD1 3.9Å; I289-I356 HydrophobicContact CG2-CD1 4.1Å; I289-I358 HydrophobicContact CD1-CD1 3.68Å; I289-I358 HydrophobicContact CD1-CG1 4.49Å; I289-I358 HydrophobicContact CD1-CG2 4.27Å; I289-I380 HydrophobicContact CD1-CG2 3.9Å; I289-I380 HydrophobicContact CG1-CG2 3.75Å; I289-I382 HydrophobicContact CB-CG1 4.31Å; I289-I382 HydrophobicContact CD1-CD1 4.13Å; I289-I382 HydrophobicContact CD1-CG1 4.13Å; I289-I382 HydrophobicContact CG1-CG1 4Å
290	M	98.3	Very high	86.6	Confident	1 Å²	1	62 Å²	62	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	149.2	-171.8	45.9	176.2	152.7	0	0	112.7	V292 N342 A343 I380 Q381 D383 P457 L459	M290-V292 HydrophobicContact CB-CG1 4.37Å; M290-V292 HydrophobicContact CG-CG1 4.3Å; M290-V292 HydrophobicContact SD-CG1 4.05Å; M290-N342 CarbonylContact C-O 3.56Å; M290-N342 WeakPolarHBondContact CA-O 3.31Å; M290-N342 WeakPolarHBondContact CB-O 3.48Å; M290-A343 HydrophobicContact CB-CB 3.79Å; M290-I380 CarbonylContact O-C 3.56Å; M290-I380 VanDerWaalsContact O-CA 3.31Å; M290-I380 WeakPolarHBondContact O-CA 3.26Å; M290-Q381 HydrophobicContact CE-CB 4.08Å; M290-Q381 HydrophobicContact CE-CG 3.81Å; M290-Q381 HydrophobicContact CG-CB 3.99Å; M290-Q381 VanDerWaalsContact CG-O 3.22Å; M290-Q381 WeakPolarHBondContact CG-O 3.2Å; M290-Q381 PolarHBondContact N-O 2.68Å; M290-Q381 PolarHBondContact O-N 3.34Å; M290-Q381 HydrophobicContact SD-CB 4.42Å; M290-D383 HydrophobicContact CE-CB 3.95Å; M290-D383 VanDerWaalsContact CE-OD1 3.31Å; M290-D383 WeakPolarHBondContact CE-OD1 3.39Å; M290-D383 WeakPolarHBondContact CE-OD2 3.3Å; M290-P457 HydrophobicContact CE-CB 4.03Å; M290-P457 HydrophobicContact CE-CG 3.74Å; M290-P457 HydrophobicContact SD-CB 3.31Å; M290-P457 WeakPolarHBondContact SD-CB 3.47Å; M290-P457 HydrophobicContact SD-CG 3.41Å; M290-P457 WeakPolarHBondContact SD-CG 3.05Å; M290-L459 HydrophobicContact SD-CD2 4.48Å
291	V	98.4	Very high	88.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.6	170.2	-179.3	0	0	0	0	108.2	W306 V320 L321 N342 V360 L378 M379 I402	V291-W306 HydrophobicContact CG1-CH2 4.14Å; V291-W306 WeakPolarHBondContact O-CZ2 3.16Å; V291-V320 HydrophobicContact CB-CG1 3.98Å; V291-V320 HydrophobicContact CG1-CG1 4.11Å; V291-V320 HydrophobicContact CG2-CG1 4.39Å; V291-L321 HydrophobicContact CG2-CB 4.21Å; V291-L321 HydrophobicContact CG2-CD1 4.01Å; V291-L321 HydrophobicContact CG2-CD2 4.4Å; V291-L321 HydrophobicContact CG2-CG 4.45Å; V291-N342 PolarHBondContact N-O 3.05Å; V291-N342 PolarHBondContact O-ND2 3.29Å; V291-V360 HydrophobicContact CG1-CG1 4.35Å; V291-V360 HydrophobicContact CG2-CG1 4.14Å; V291-V360 HydrophobicContact CG2-CG2 3.91Å; V291-L378 HydrophobicContact CG1-CD2 4.49Å; V291-M379 WeakPolarHBondContact CA-O 2.98Å; V291-I402 HydrophobicContact CG1-CD1 4.43Å
292	V	97.1	Very high	90.8	Very high	6 Å²	6	52 Å²	52	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	163	-177.7	-62	0	0	0	0	110.7	M290 M379 Q381 P457	M290-V292 HydrophobicContact CB-CG1 4.37Å; M290-V292 HydrophobicContact CG-CG1 4.3Å; M290-V292 HydrophobicContact SD-CG1 4.05Å; V292-M379 HydrophobicContact CG2-CE 4.03Å; V292-M379 HydrophobicContact CG2-CG 3.58Å; V292-M379 HydrophobicContact CG2-SD 4.36Å; V292-M379 PolarHBondContact N-O 3.42Å; V292-M379 PolarHBondContact O-N 2.78Å; V292-Q381 HydrophobicContact CG2-CB 4.11Å; V292-P457 HydrophobicContact CG1-CB 4.14Å
293	F	96.1	Very high	92.4	Very high	13 Å²	13	49 Å²	49	6%	0.057	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	137.1	172.3	-62.6	-75	0	0	0	109.4	E295 Q302 Y305 W306 F367 L376 L378	F293-E295 VanDerWaalsContact C-N 3.33Å; F293-Q302 HydrophobicContact CD2-CB 3.82Å; F293-Q302 HydrophobicContact CD2-CG 3.73Å; F293-Q302 HydrophobicContact CE2-CB 4.11Å; F293-Q302 HydrophobicContact CE2-CG 4.47Å; F293-Q302 HydrophobicContact CG-CG 4.48Å; F293-Y305 HydrophobicContact CE1-CD2 4.4Å; F293-Y305 HydrophobicContact CE2-CD2 4.25Å; F293-Y305 VanDerWaalsContact CZ-CB 3.44Å; F293-Y305 HydrophobicContact CZ-CD2 4.11Å; F293-Y305 HydrophobicContact CZ-CG 4.17Å; F293-W306 HydrophobicContact CD2-CZ2 4.26Å; F293-W306 AromaticContact CD2-NE1 3.99Å; F293-W306 AromaticContact CE2-CD1 3.89Å; F293-W306 AromaticContact CE2-CD2 3.98Å; F293-W306 HydrophobicContact CE2-CD2 3.98Å; F293-W306 AromaticContact CE2-CE2 3.42Å; F293-W306 VanDerWaalsContact CE2-CE2 3.42Å; F293-W306 HydrophobicContact CE2-CG 4.24Å; F293-W306 AromaticContact CE2-CZ2 3.74Å; F293-W306 HydrophobicContact CE2-CZ2 3.74Å; F293-W306 AromaticContact CE2-NE1 3.4Å; F293-W306 HydrophobicContact CZ-CD2 4.16Å; F293-W306 AromaticContact CZ-CE2 3.88Å; F293-W306 HydrophobicContact CZ-CH2 4.3Å; F293-W306 AromaticContact CZ-CZ2 3.97Å; F293-W306 HydrophobicContact CZ-CZ2 3.97Å; F293-F367 HydrophobicContact CE1-CD1 4.03Å; F293-F367 HydrophobicContact CE1-CD2 4.12Å; F293-F367 AromaticContact CE1-CE1 3.92Å; F293-F367 HydrophobicContact CE1-CE1 3.92Å; F293-F367 HydrophobicContact CE1-CE2 4.03Å; F293-F367 HydrophobicContact CE1-CG 4.11Å; F293-F367 AromaticContact CE1-CZ 3.91Å; F293-F367 HydrophobicContact CE1-CZ 3.91Å; F293-F367 AromaticContact CZ-CD1 3.83Å; F293-F367 HydrophobicContact CZ-CD1 3.83Å; F293-F367 AromaticContact CZ-CE1 3.62Å; F293-F367 HydrophobicContact CZ-CE1 3.62Å; F293-F367 HydrophobicContact CZ-CG 4.35Å; F293-F367 HydrophobicContact CZ-CZ 4.01Å; F293-L376 HydrophobicContact CD1-CB 4.35Å; F293-L376 HydrophobicContact CD1-CD1 4.25Å; F293-L376 HydrophobicContact CE1-CB 4.32Å; F293-L376 HydrophobicContact CE1-CD1 3.82Å; F293-L378 HydrophobicContact CD1-CD2 3.7Å; F293-L378 HydrophobicContact CE1-CD2 3.73Å
294	S	88.8	Confident	93	Very high	36 Å²	36	54.2 Å²	54.2	25%	0.252	26%	0.258	S	S	.	.	S	Bend	trans	-81.9	-13	179.2	177.6	0	0	0	0	113.2	P377	S294-P377 PolarHBondContact N-O 2.87Å
295	E	81.7	Confident	93.4	Very high	87 Å²	87	52.2 Å²	52.2	41%	0.407	25%	0.248	S	C	.	.	S	Bend	trans	-86.6	144	176.1	-84.5	172.8	-159.3	0	0	110.6	F293 K297 P377	F293-E295 VanDerWaalsContact C-N 3.33Å; E295-K297 HydrophobicContact CB-CG 4.08Å; E295-K297 PolarHBondContact O-N 2.83Å; E295-K297 WeakPolarHBondContact OE2-CE 3.37Å; E295-K297 IonicContact OE2-NZ 2.59Å; E295-P377 HydrophobicContact CB-CG 4.33Å; E295-P377 HydrophobicContact CG-CG 3.57Å; E295-P377 VanDerWaalsContact OE1-CG 3.28Å; E295-P377 WeakPolarHBondContact OE1-CG 3.22Å
296	D	75	Confident	93.6	Very high	174 Å²	174	51.7 Å²	51.7	93%	0.93	25%	0.245	S	C	*	.			trans	-72.6	67.1	174.1	-57.7	-46.1	0	0	0	110.6
297	K	86.2	Confident	93.6	Very high	76 Å²	76	53.8 Å²	53.8	33%	0.33	26%	0.256	S	S	.	.			trans	-89.2	144.5	169.6	-59.8	-55.1	-170.5	172.8	0	109.2	E295 E301 Q302	E295-K297 HydrophobicContact CB-CG 4.08Å; E295-K297 PolarHBondContact O-N 2.83Å; E295-K297 WeakPolarHBondContact OE2-CE 3.37Å; E295-K297 IonicContact OE2-NZ 2.59Å; K297-E301 HydrophobicContact CB-CB 4.24Å; K297-E301 WeakPolarHBondContact CD-OE2 3.22Å; K297-Q302 HydrophobicContact CB-CG 3.92Å; K297-Q302 PolarHBondContact O-NE2 3.24Å
298	N	92.1	Very high	93.6	Very high	81 Å²	81	57 Å²	57	43%	0.433	27%	0.268	S	S	.	.			trans	-60.2	160.3	173.3	64	52.7	0	0	0	111.1	D300 E301 Q302	N298-D300 VanDerWaalsContact C-N 3.27Å; N298-D300 PolarHBondContact O-N 2.93Å; N298-D300 PolarHBondContact OD1-N 2.96Å; N298-E301 PolarHBondContact ND2-OE1 2.98Å; N298-E301 PolarHBondContact O-N 3.44Å; N298-E301 WeakPolarHBondContact OD1-CB 3.39Å; N298-E301 WeakPolarHBondContact OD1-CG 3.3Å; N298-E301 PolarHBondContact OD1-N 2.65Å; N298-Q302 PolarHBondContact O-N 3.17Å
299	R	93.1	Very high	93.5	Very high	122 Å²	122	56.7 Å²	56.7	46%	0.46	27%	0.267	S	S	.	.	H	α-helix	trans	-53.2	-43.9	-177.7	-179.6	179.3	178.2	87.1	1.1	112.6	Q302 L303 V458	R299-Q302 PolarHBondContact O-N 3.11Å; R299-L303 HydrophobicContact CG-CD1 4.01Å; R299-L303 HydrophobicContact CG-CG 4.49Å; R299-L303 WeakPolarHBondContact O-CG 3.39Å; R299-L303 PolarHBondContact O-N 2.81Å; R299-V458 HydrophobicContact CB-CG2 4.29Å; R299-V458 HydrophobicContact CG-CG1 4.29Å; R299-V458 HydrophobicContact CG-CG2 4.13Å
300	D	94.7	Very high	93.4	Very high	106 Å²	106	57.9 Å²	57.9	57%	0.567	27%	0.272	S	S	*	.	H	α-helix	trans	-68.9	-37.5	-174.7	-64.4	-34.5	0	0	0	112.8	N298 L303 K304	N298-D300 VanDerWaalsContact C-N 3.27Å; N298-D300 PolarHBondContact O-N 2.93Å; N298-D300 PolarHBondContact OD1-N 2.96Å; D300-L303 PolarHBondContact O-N 3.13Å; D300-K304 VanDerWaalsContact O-CG 3.27Å; D300-K304 WeakPolarHBondContact O-CG 3.37Å; D300-K304 PolarHBondContact O-N 3.43Å
301	E	94.7	Very high	93.3	Very high	61 Å²	61	62 Å²	62	29%	0.285	30%	0.302	S	S	.	.	H	α-helix	trans	-65	-44.4	174	-78.8	175.8	-146.6	0	0	111.8	K297 N298 L303 K304 Y305	K297-E301 HydrophobicContact CB-CB 4.24Å; K297-E301 WeakPolarHBondContact CD-OE2 3.22Å; N298-E301 PolarHBondContact ND2-OE1 2.98Å; N298-E301 PolarHBondContact O-N 3.44Å; N298-E301 WeakPolarHBondContact OD1-CB 3.39Å; N298-E301 WeakPolarHBondContact OD1-CG 3.3Å; N298-E301 PolarHBondContact OD1-N 2.65Å; E301-L303 VanDerWaalsContact C-N 3.32Å; E301-L303 PolarHBondContact O-N 3.5Å; E301-K304 WeakPolarHBondContact O-CB 3.36Å; E301-K304 PolarHBondContact O-N 2.88Å; E301-Y305 HydrophobicContact CB-CE2 4.48Å; E301-Y305 WeakPolarHBondContact O-CD2 3.34Å; E301-Y305 PolarHBondContact O-N 3.11Å; E301-Y305 VanDerWaalsContact O-N 3.08Å
302	Q	95.3	Very high	93.2	Very high	21 Å²	21	68.7 Å²	68.7	10%	0.098	33%	0.327	C	S	.	.	H	α-helix	trans	-60.1	-44.3	175.2	-64.9	-168.3	46.7	0	0	111.3	F293 K297 N298 R299 K304 Y305 W306 V458	F293-Q302 HydrophobicContact CD2-CB 3.82Å; F293-Q302 HydrophobicContact CD2-CG 3.73Å; F293-Q302 HydrophobicContact CE2-CB 4.11Å; F293-Q302 HydrophobicContact CE2-CG 4.47Å; F293-Q302 HydrophobicContact CG-CG 4.48Å; K297-Q302 HydrophobicContact CB-CG 3.92Å; K297-Q302 PolarHBondContact O-NE2 3.24Å; N298-Q302 PolarHBondContact O-N 3.17Å; R299-Q302 PolarHBondContact O-N 3.11Å; Q302-K304 VanDerWaalsContact C-N 3.34Å; Q302-K304 PolarHBondContact O-N 2.95Å; Q302-Y305 PolarHBondContact O-N 3.09Å; Q302-W306 PolarHBondContact O-N 3.12Å; Q302-V458 HydrophobicContact CB-CB 4.2Å; Q302-V458 HydrophobicContact CB-CG1 4.04Å; Q302-V458 HydrophobicContact CB-CG2 4.14Å; Q302-V458 HydrophobicContact CG-CG2 4.35Å
303	L	95.8	Very high	93.1	Very high	33 Å²	33	70.1 Å²	70.1	17%	0.173	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-35.6	175.9	-70.7	174.3	0	0	0	112.6	R299 D300 E301 W306 K307 V458 F460	R299-L303 HydrophobicContact CG-CD1 4.01Å; R299-L303 HydrophobicContact CG-CG 4.49Å; R299-L303 WeakPolarHBondContact O-CG 3.39Å; R299-L303 PolarHBondContact O-N 2.81Å; D300-L303 PolarHBondContact O-N 3.13Å; E301-L303 VanDerWaalsContact C-N 3.32Å; E301-L303 PolarHBondContact O-N 3.5Å; L303-W306 PolarHBondContact O-N 2.99Å; L303-K307 WeakPolarHBondContact O-CB 3.38Å; L303-K307 VanDerWaalsContact O-CG 3.32Å; L303-K307 WeakPolarHBondContact O-CG 3.36Å; L303-K307 PolarHBondContact O-N 3.08Å; L303-V458 HydrophobicContact CD2-CG1 3.75Å; L303-V458 HydrophobicContact CG-CG1 3.83Å; L303-F460 HydrophobicContact CD2-CD2 4.28Å
304	K	95.6	Very high	92.8	Very high	140 Å²	140	79.1 Å²	79.1	61%	0.609	38%	0.375	S	S	*	.	H	α-helix	trans	-60.1	-44.8	172.8	-76.4	168.4	-172.5	170.8	0	111.4	D300 E301 Q302 K307 Y308	D300-K304 VanDerWaalsContact O-CG 3.27Å; D300-K304 WeakPolarHBondContact O-CG 3.37Å; D300-K304 PolarHBondContact O-N 3.43Å; E301-K304 WeakPolarHBondContact O-CB 3.36Å; E301-K304 PolarHBondContact O-N 2.88Å; Q302-K304 VanDerWaalsContact C-N 3.34Å; Q302-K304 PolarHBondContact O-N 2.95Å; K304-K307 PolarHBondContact O-N 3.12Å; K304-Y308 VanDerWaalsContact O-CB 3.28Å; K304-Y308 WeakPolarHBondContact O-CB 3.36Å; K304-Y308 PolarHBondContact O-N 3.31Å
305	Y	96.3	Very high	93	Very high	63 Å²	63	80.6 Å²	80.6	25%	0.247	38%	0.382	C	S	.	.	H	α-helix	trans	-64.1	-42.2	176.8	-63	-47.8	0	0	0	112.2	F293 E301 Q302 Y308 W309 F367 L376	F293-Y305 HydrophobicContact CE1-CD2 4.4Å; F293-Y305 HydrophobicContact CE2-CD2 4.25Å; F293-Y305 VanDerWaalsContact CZ-CB 3.44Å; F293-Y305 HydrophobicContact CZ-CD2 4.11Å; F293-Y305 HydrophobicContact CZ-CG 4.17Å; E301-Y305 HydrophobicContact CB-CE2 4.48Å; E301-Y305 WeakPolarHBondContact O-CD2 3.34Å; E301-Y305 PolarHBondContact O-N 3.11Å; E301-Y305 VanDerWaalsContact O-N 3.08Å; Q302-Y305 PolarHBondContact O-N 3.09Å; Y305-Y308 PolarHBondContact O-N 3.33Å; Y305-W309 WeakPolarHBondContact O-CB 3.47Å; Y305-W309 PolarHBondContact O-N 3.49Å; Y305-F367 HydrophobicContact CD1-CB 4.3Å; Y305-L376 HydrophobicContact CD1-CD1 3.91Å; Y305-L376 HydrophobicContact CD2-CD1 3.82Å; Y305-L376 HydrophobicContact CE1-CD1 4.03Å; Y305-L376 HydrophobicContact CE2-CD1 3.96Å; Y305-L376 HydrophobicContact CG-CD1 3.83Å
306	W	97.3	Very high	93.4	Very high	0 Å²	0	78.9 Å²	78.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-44.1	176.6	-70.2	129.7	0	0	0	112.9	V291 F293 Q302 L303 Y308 W309 H310 V320 N342 F367 L378 F460	V291-W306 HydrophobicContact CG1-CH2 4.14Å; V291-W306 WeakPolarHBondContact O-CZ2 3.16Å; F293-W306 HydrophobicContact CD2-CZ2 4.26Å; F293-W306 AromaticContact CD2-NE1 3.99Å; F293-W306 AromaticContact CE2-CD1 3.89Å; F293-W306 AromaticContact CE2-CD2 3.98Å; F293-W306 HydrophobicContact CE2-CD2 3.98Å; F293-W306 AromaticContact CE2-CE2 3.42Å; F293-W306 VanDerWaalsContact CE2-CE2 3.42Å; F293-W306 HydrophobicContact CE2-CG 4.24Å; F293-W306 AromaticContact CE2-CZ2 3.74Å; F293-W306 HydrophobicContact CE2-CZ2 3.74Å; F293-W306 AromaticContact CE2-NE1 3.4Å; F293-W306 HydrophobicContact CZ-CD2 4.16Å; F293-W306 AromaticContact CZ-CE2 3.88Å; F293-W306 HydrophobicContact CZ-CH2 4.3Å; F293-W306 AromaticContact CZ-CZ2 3.97Å; F293-W306 HydrophobicContact CZ-CZ2 3.97Å; Q302-W306 PolarHBondContact O-N 3.12Å; L303-W306 PolarHBondContact O-N 2.99Å; W306-Y308 VanDerWaalsContact C-N 3.34Å; W306-Y308 PolarHBondContact O-N 3.26Å; W306-W309 PolarHBondContact O-N 3.4Å; W306-H310 WeakPolarHBondContact O-CB 3.43Å; W306-H310 PolarHBondContact O-N 2.9Å; W306-V320 HydrophobicContact CE3-CG2 3.76Å; W306-V320 HydrophobicContact CH2-CG1 3.76Å; W306-V320 HydrophobicContact CH2-CG2 4.32Å; W306-V320 HydrophobicContact CZ3-CB 4.22Å; W306-V320 HydrophobicContact CZ3-CG1 3.65Å; W306-V320 HydrophobicContact CZ3-CG2 3.5Å; W306-N342 HydrophobicContact CZ2-CB 4.41Å; W306-F367 AromaticContact CE3-CE1 3.76Å; W306-F367 HydrophobicContact CE3-CE1 3.76Å; W306-F367 HydrophobicContact CE3-CZ 4.28Å; W306-F367 HydrophobicContact CH2-CE1 4.26Å; W306-F367 HydrophobicContact CH2-CZ 4.03Å; W306-F367 AromaticContact CZ3-CE1 3.58Å; W306-F367 HydrophobicContact CZ3-CE1 3.58Å; W306-F367 AromaticContact CZ3-CZ 3.63Å; W306-F367 HydrophobicContact CZ3-CZ 3.63Å; W306-L378 HydrophobicContact CH2-CD2 4.46Å; W306-F460 HydrophobicContact CB-CB 3.91Å; W306-F460 HydrophobicContact CB-CD1 3.89Å; W306-F460 HydrophobicContact CB-CD2 3.56Å; W306-F460 HydrophobicContact CB-CE1 4.31Å; W306-F460 HydrophobicContact CB-CE2 4.01Å; W306-F460 HydrophobicContact CB-CG 3.49Å; W306-F460 VanDerWaalsContact CB-CG 3.49Å; W306-F460 HydrophobicContact CB-CZ 4.36Å; W306-F460 HydrophobicContact CD2-CB 4.44Å; W306-F460 HydrophobicContact CG-CB 3.8Å; W306-F460 HydrophobicContact CG-CD1 4.4Å; W306-F460 HydrophobicContact CG-CD2 4.37Å; W306-F460 AromaticContact CG-CG 3.94Å; W306-F460 HydrophobicContact CG-CG 3.94Å
307	K	96.1	Very high	94.2	Very high	102 Å²	102	78.4 Å²	78.4	44%	0.443	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-43	174.5	-73	-173.6	-175.1	-150.4	0	111.3	L303 K304 H310 S311 F460 D463	L303-K307 WeakPolarHBondContact O-CB 3.38Å; L303-K307 VanDerWaalsContact O-CG 3.32Å; L303-K307 WeakPolarHBondContact O-CG 3.36Å; L303-K307 PolarHBondContact O-N 3.08Å; K304-K307 PolarHBondContact O-N 3.12Å; K307-H310 PolarHBondContact O-N 3.2Å; K307-S311 WeakPolarHBondContact O-CB 3.5Å; K307-S311 PolarHBondContact O-N 3.13Å; K307-S311 PolarHBondContact O-OG 3.1Å; K307-F460 HydrophobicContact CG-CE2 3.85Å; K307-D463 IonicContact NZ-OD2 2.71Å; K307-D463 PolarHBondContact NZ-OD2 2.87Å
308	Y	96.3	Very high	94.6	Very high	67 Å²	67	77.3 Å²	77.3	26%	0.263	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-48.5	175.6	177.3	-97.8	0	0	0	111.8	K304 Y305 W306 H310 S311 R312 D366 S369	K304-Y308 VanDerWaalsContact O-CB 3.28Å; K304-Y308 WeakPolarHBondContact O-CB 3.36Å; K304-Y308 PolarHBondContact O-N 3.31Å; Y305-Y308 PolarHBondContact O-N 3.33Å; W306-Y308 VanDerWaalsContact C-N 3.34Å; W306-Y308 PolarHBondContact O-N 3.26Å; Y308-H310 PolarHBondContact O-N 3.05Å; Y308-S311 PolarHBondContact O-N 2.92Å; Y308-S311 PolarHBondContact O-OG 3.44Å; Y308-R312 WeakPolarHBondContact O-CG 3.45Å; Y308-R312 PolarHBondContact OH-NH1 3.17Å; Y308-R312 VanDerWaalsContact OH-NH1 3.11Å; Y308-D366 VanDerWaalsContact CE1-O 3.24Å; Y308-D366 WeakPolarHBondContact CE1-O 3.44Å; Y308-S369 WeakPolarHBondContact OH-CA 3.48Å; Y308-S369 VanDerWaalsContact OH-CB 3.29Å; Y308-S369 WeakPolarHBondContact OH-CB 3.28Å; Y308-S369 PolarHBondContact OH-N 3.16Å; Y308-S369 VanDerWaalsContact OH-N 3.11Å
309	W	97.1	Very high	94.9	Very high	1 Å²	1	74.3 Å²	74.3	0%	0.004	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-48.2	175.4	171.8	86.6	0	0	0	111.7	Y305 W306 S311 R312 Q313 Q318 V320 N361 C362 F367	Y305-W309 WeakPolarHBondContact O-CB 3.47Å; Y305-W309 PolarHBondContact O-N 3.49Å; W306-W309 PolarHBondContact O-N 3.4Å; W309-S311 PolarHBondContact O-N 3.33Å; W309-R312 PolarHBondContact O-N 3.18Å; W309-Q313 HydrophobicContact CD2-CG 4.3Å; W309-Q313 VanDerWaalsContact CE2-NE2 3.29Å; W309-Q313 HydrophobicContact CE3-CG 4.29Å; W309-Q313 HydrophobicContact CH2-CG 3.87Å; W309-Q313 HydrophobicContact CZ2-CG 3.88Å; W309-Q313 HydrophobicContact CZ3-CG 4.07Å; W309-Q313 PolarHBondContact O-NE2 3.02Å; W309-Q318 HydrophobicContact CH2-CG 4.04Å; W309-Q318 WeakPolarHBondContact CH2-O 3.33Å; W309-Q318 HydrophobicContact CZ2-CG 4.26Å; W309-V320 HydrophobicContact CD2-CG2 4.23Å; W309-V320 HydrophobicContact CE3-CG2 3.7Å; W309-V320 HydrophobicContact CH2-CB 4.37Å; W309-V320 HydrophobicContact CH2-CG2 3.58Å; W309-V320 HydrophobicContact CZ2-CG2 4.1Å; W309-V320 HydrophobicContact CZ3-CG2 3.36Å; W309-N361 HydrophobicContact CZ2-CB 4.48Å; W309-C362 HydrophobicContact CD2-CB 4.44Å; W309-C362 HydrophobicContact CG-CB 4.39Å; W309-C362 HydrophobicContact CZ2-CB 4.34Å; W309-F367 HydrophobicContact CB-CD1 4.02Å; W309-F367 HydrophobicContact CB-CE1 3.85Å; W309-F367 HydrophobicContact CG-CE1 4.2Å
310	H	96.6	Very high	95.1	Very high	25 Å²	25	68.5 Å²	68.5	12%	0.116	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-40.9	-176.8	-175.1	-103.4	0	0	0	112.2	W306 K307 Y308 R312 Q313 A316 Y341 F460	W306-H310 WeakPolarHBondContact O-CB 3.43Å; W306-H310 PolarHBondContact O-N 2.9Å; K307-H310 PolarHBondContact O-N 3.2Å; Y308-H310 PolarHBondContact O-N 3.05Å; H310-R312 PolarHBondContact O-N 3.3Å; H310-Q313 WeakPolarHBondContact O-CB 3.46Å; H310-Q313 PolarHBondContact O-N 3.5Å; H310-A316 PolarHBondContact NE2-O 3.19Å; H310-Y341 AromaticContact CD2-CE1 3.95Å; H310-Y341 AromaticContact NE2-CE1 3.63Å; H310-F460 HydrophobicContact CB-CE1 3.74Å; H310-F460 HydrophobicContact CB-CZ 3.7Å; H310-F460 AromaticContact CG-CE1 3.94Å; H310-F460 AromaticContact CG-CZ 3.95Å
311	S	95.3	Very high	95.3	Very high	89 Å²	89	63.4 Å²	63.4	62%	0.622	30%	0.302	S	S	*	.	H	α-helix	trans	-59.8	-18.8	177.7	73.6	0	0	0	0	114.4	K307 Y308 W309	K307-S311 WeakPolarHBondContact O-CB 3.5Å; K307-S311 PolarHBondContact O-N 3.13Å; K307-S311 PolarHBondContact O-OG 3.1Å; Y308-S311 PolarHBondContact O-N 2.92Å; Y308-S311 PolarHBondContact O-OG 3.44Å; W309-S311 PolarHBondContact O-N 3.33Å
312	R	95.4	Very high	95.4	Very high	140 Å²	140	62.3 Å²	62.3	53%	0.528	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-3.7	-179.2	-64.1	170.5	61.7	90.2	7.9	113	Y308 W309 H310	Y308-R312 WeakPolarHBondContact O-CG 3.45Å; Y308-R312 PolarHBondContact OH-NH1 3.17Å; Y308-R312 VanDerWaalsContact OH-NH1 3.11Å; W309-R312 PolarHBondContact O-N 3.18Å; H310-R312 PolarHBondContact O-N 3.3Å
313	Q	94.9	Very high	95.5	Very high	35 Å²	35	62.3 Å²	62.3	16%	0.164	30%	0.299	C	S	.	.	S	Bend	trans	-76.2	142.7	177.3	-56.8	-47.7	-57.5	0	0	110.3	W309 H310 T315 Q318	W309-Q313 HydrophobicContact CD2-CG 4.3Å; W309-Q313 VanDerWaalsContact CE2-NE2 3.29Å; W309-Q313 HydrophobicContact CE3-CG 4.29Å; W309-Q313 HydrophobicContact CH2-CG 3.87Å; W309-Q313 HydrophobicContact CZ2-CG 3.88Å; W309-Q313 HydrophobicContact CZ3-CG 4.07Å; W309-Q313 PolarHBondContact O-NE2 3.02Å; H310-Q313 WeakPolarHBondContact O-CB 3.46Å; H310-Q313 PolarHBondContact O-N 3.5Å; Q313-T315 PolarHBondContact O-N 3.42Å; Q313-Q318 HydrophobicContact CB-CB 3.85Å; Q313-Q318 HydrophobicContact CB-CG 4.22Å; Q313-Q318 HydrophobicContact CG-CB 4.01Å; Q313-Q318 HydrophobicContact CG-CG 3.99Å
314	H	91.4	Very high	95.4	Very high	203 Å²	203	61.1 Å²	61.1	94%	0.94	29%	0.294	S	S	*	.	S	Bend	trans	-66.7	-22.8	178.1	-63.8	-62.7	0	0	0	113.1
315	T	92.4	Very high	95.1	Very high	66 Å²	66	60.6 Å²	60.6	41%	0.405	30%	0.297	S	S	.	.	S	Bend	trans	-130.5	134.7	178.6	177.4	0	0	0	0	110.4	Q313 K317 Q318	Q313-T315 PolarHBondContact O-N 3.42Å; T315-K317 PolarHBondContact O-N 2.89Å; T315-K317 PolarHBondContact OG1-N 2.88Å; T315-Q318 HydrophobicContact CG2-CB 3.73Å; T315-Q318 VanDerWaalsContact O-CB 3.29Å; T315-Q318 WeakPolarHBondContact O-CB 3.18Å; T315-Q318 PolarHBondContact O-N 3.18Å
316	A	89.6	Confident	94.7	Very high	52 Å²	52	62.9 Å²	62.9	43%	0.43	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.4	176.3	0	0	0	0	0	112.5	H310 Q318 Y341	H310-A316 PolarHBondContact NE2-O 3.19Å; A316-Q318 VanDerWaalsContact C-N 3.29Å; A316-Y341 WeakPolarHBondContact O-CE1 3.32Å; A316-Y341 PolarHBondContact O-OH 3.1Å
317	K	91.6	Very high	93.8	Very high	163 Å²	163	71 Å²	71	71%	0.709	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-5.8	176.4	-63.3	-173.1	177.4	-175.7	0	113.5	T315 R319	T315-K317 PolarHBondContact O-N 2.89Å; T315-K317 PolarHBondContact OG1-N 2.88Å; K317-R319 PolarHBondContact O-N 3.46Å; K317-R319 VanDerWaalsContact O-N 3.13Å
318	Q	95.3	Very high	92.7	Very high	54 Å²	54	71 Å²	71	25%	0.252	34%	0.343	S	S	.	.			trans	-67.3	114.9	-177.7	-175.4	62.3	64.3	0	0	109.8	W309 Q313 T315 A316 Y341 N361	W309-Q318 HydrophobicContact CH2-CG 4.04Å; W309-Q318 WeakPolarHBondContact CH2-O 3.33Å; W309-Q318 HydrophobicContact CZ2-CG 4.26Å; Q313-Q318 HydrophobicContact CB-CB 3.85Å; Q313-Q318 HydrophobicContact CB-CG 4.22Å; Q313-Q318 HydrophobicContact CG-CB 4.01Å; Q313-Q318 HydrophobicContact CG-CG 3.99Å; T315-Q318 HydrophobicContact CG2-CB 3.73Å; T315-Q318 VanDerWaalsContact O-CB 3.29Å; T315-Q318 WeakPolarHBondContact O-CB 3.18Å; T315-Q318 PolarHBondContact O-N 3.18Å; A316-Q318 VanDerWaalsContact C-N 3.29Å; Q318-Y341 VanDerWaalsContact O-CD1 3.3Å; Q318-Y341 WeakPolarHBondContact O-CD1 3.16Å; Q318-Y341 WeakPolarHBondContact O-CE1 3.34Å; Q318-N361 PolarHBondContact NE2-ND2 3.35Å; Q318-N361 VanDerWaalsContact NE2-ND2 3.16Å
319	R	97.6	Very high	91.6	Very high	17 Å²	17	67.9 Å²	67.9	6%	0.064	33%	0.331	C	S	.	.			trans	-88.5	156.1	176.9	-61.9	173.6	53.9	78.4	11	110.7	K317 L321 D322 E338 A340 Y341 A343 N361	K317-R319 PolarHBondContact O-N 3.46Å; K317-R319 VanDerWaalsContact O-N 3.13Å; R319-L321 PolarHBondContact NE-O 3.19Å; R319-L321 PolarHBondContact NH2-O 3.36Å; R319-D322 WeakPolarHBondContact CB-OD1 3.38Å; R319-D322 WeakPolarHBondContact CD-OD1 3.22Å; R319-D322 IonicContact NE-OD1 3.85Å; R319-D322 PolarHBondContact NE-OD1 2.82Å; R319-E338 VanDerWaalsContact CD-OE2 3.22Å; R319-E338 WeakPolarHBondContact CD-OE2 3.47Å; R319-E338 IonicContact CZ-OE2 3.37Å; R319-E338 IonicContact NE-OE2 3.19Å; R319-E338 PolarHBondContact NE-OE2 2.8Å; R319-E338 IonicContact NH1-OE2 3.11Å; R319-E338 PolarHBondContact NH1-OE2 3.43Å; R319-A340 PolarHBondContact NH1-O 3.5Å; R319-A340 PolarHBondContact NH2-O 2.98Å; R319-Y341 HydrophobicContact CG-CD1 4.27Å; R319-Y341 HydrophobicContact CG-CE1 4.43Å; R319-Y341 HydrophobicContact CG-CG 4.43Å; R319-A343 PolarHBondContact NH2-O 2.98Å; R319-N361 WeakPolarHBondContact O-CB 3.04Å; R319-N361 PolarHBondContact O-ND2 2.86Å
320	V	98.4	Very high	90.7	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.351	C	S	.	.	S	Bend	trans	-75.6	-39	173.2	174.7	0	0	0	0	110.2	V291 W306 W309 Y341 N342 V360 N361 C362	V291-V320 HydrophobicContact CB-CG1 3.98Å; V291-V320 HydrophobicContact CG1-CG1 4.11Å; V291-V320 HydrophobicContact CG2-CG1 4.39Å; W306-V320 HydrophobicContact CE3-CG2 3.76Å; W306-V320 HydrophobicContact CH2-CG1 3.76Å; W306-V320 HydrophobicContact CH2-CG2 4.32Å; W306-V320 HydrophobicContact CZ3-CB 4.22Å; W306-V320 HydrophobicContact CZ3-CG1 3.65Å; W306-V320 HydrophobicContact CZ3-CG2 3.5Å; W309-V320 HydrophobicContact CD2-CG2 4.23Å; W309-V320 HydrophobicContact CE3-CG2 3.7Å; W309-V320 HydrophobicContact CH2-CB 4.37Å; W309-V320 HydrophobicContact CH2-CG2 3.58Å; W309-V320 HydrophobicContact CZ2-CG2 4.1Å; W309-V320 HydrophobicContact CZ3-CG2 3.36Å; V320-Y341 WeakPolarHBondContact CA-O 3.31Å; V320-Y341 WeakPolarHBondContact CB-O 3.46Å; V320-Y341 PolarHBondContact N-O 2.91Å; V320-N342 HydrophobicContact CB-CB 3.95Å; V320-N342 HydrophobicContact CG1-CB 4.11Å; V320-N342 HydrophobicContact CG2-CB 4.29Å; V320-V360 WeakPolarHBondContact O-CA 3.05Å; V320-N361 PolarHBondContact O-N 3.44Å; V320-C362 HydrophobicContact CG1-CB 4.49Å
321	L	98.5	Very high	90	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.2	-177.7	-176.8	65.6	0	0	0	109.7	I289 V291 R319 Y341 I344 I358 T359 V360	I289-L321 HydrophobicContact CG1-CD2 4.36Å; I289-L321 HydrophobicContact CG2-CD2 4.11Å; I289-L321 WeakPolarHBondContact O-CD2 3.28Å; V291-L321 HydrophobicContact CG2-CB 4.21Å; V291-L321 HydrophobicContact CG2-CD1 4.01Å; V291-L321 HydrophobicContact CG2-CD2 4.4Å; V291-L321 HydrophobicContact CG2-CG 4.45Å; R319-L321 PolarHBondContact NE-O 3.19Å; R319-L321 PolarHBondContact NH2-O 3.36Å; L321-Y341 PolarHBondContact N-O 2.89Å; L321-Y341 VanDerWaalsContact N-O 3.14Å; L321-I344 HydrophobicContact CD2-CD1 4.38Å; L321-I344 HydrophobicContact CD2-CG1 4.25Å; L321-I344 HydrophobicContact CG-CD1 4.01Å; L321-I344 HydrophobicContact CG-CG1 4.32Å; L321-I358 HydrophobicContact CD1-CB 3.98Å; L321-I358 HydrophobicContact CD1-CD1 3.97Å; L321-I358 HydrophobicContact CD1-CG2 4.39Å; L321-T359 WeakPolarHBondContact CA-O 3.42Å; L321-T359 WeakPolarHBondContact CD1-O 3.13Å; L321-V360 HydrophobicContact CD1-CG2 4.34Å
322	D	97.4	Very high	89.5	Confident	38 Å²	38	73.9 Å²	73.9	20%	0.203	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.2	174.6	-70.7	-42.6	0	0	0	110.8	R319 I358 T359 N361	R319-D322 WeakPolarHBondContact CB-OD1 3.38Å; R319-D322 WeakPolarHBondContact CD-OD1 3.22Å; R319-D322 IonicContact NE-OD1 3.85Å; R319-D322 PolarHBondContact NE-OD1 2.82Å; D322-I358 CarbonylContact O-C 3.59Å; D322-I358 VanDerWaalsContact O-CA 3.24Å; D322-I358 WeakPolarHBondContact O-CA 3.22Å; D322-T359 HydrophobicContact CB-CG2 3.77Å; D322-T359 PolarHBondContact N-O 2.91Å; D322-T359 VanDerWaalsContact N-O 3.15Å; D322-T359 PolarHBondContact O-N 3.08Å; D322-N361 PolarHBondContact OD2-ND2 3.29Å
323	I	96.1	Very high	89.4	Confident	21 Å²	21	67.7 Å²	67.7	11%	0.108	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	140.7	175.3	-170.9	168.1	0	0	0	109.3	I333 I336 I344 I356 F357	I323-I333 HydrophobicContact CD1-CD1 4.11Å; I323-I336 HydrophobicContact CG2-CG2 4.31Å; I323-I344 HydrophobicContact CB-CD1 3.75Å; I323-I344 HydrophobicContact CG2-CD1 3.95Å; I323-I356 HydrophobicContact CD1-CB 4.13Å; I323-I356 HydrophobicContact CD1-CG2 4.25Å; I323-F357 CarbonylContact C-O 3.5Å; I323-F357 WeakPolarHBondContact CA-O 3.42Å
324	A	94.9	Very high	89.2	Confident	7 Å²	7	67.3 Å²	67.3	6%	0.058	34%	0.337	C	S	.	.			trans	-82.7	144	177.7	0	0	0	0	0	111.5	F264 Y326 F357	F264-A324 HydrophobicContact CD1-CB 3.66Å; F264-A324 HydrophobicContact CE1-CB 3.6Å; F264-A324 HydrophobicContact CG-CB 4.15Å; F264-A324 HydrophobicContact CZ-CB 4.05Å; A324-Y326 HydrophobicContact CB-CD1 4.13Å; A324-Y326 HydrophobicContact CB-CD2 4.07Å; A324-Y326 HydrophobicContact CB-CE1 4.06Å; A324-Y326 HydrophobicContact CB-CE2 3.98Å; A324-Y326 HydrophobicContact CB-CG 4.12Å; A324-Y326 PolarHBondContact O-N 3.47Å; A324-F357 HydrophobicContact CB-CB 3.88Å; A324-F357 PolarHBondContact N-O 3.31Å
325	D	89.7	Confident	89.3	Confident	129 Å²	129	62 Å²	62	69%	0.69	32%	0.315	S	S	*	.			trans	-83.9	47.3	177.7	-65.2	-26.1	0	0	0	113	F330	D325-F330 HydrophobicContact CB-CE2 3.74Å; D325-F330 HydrophobicContact CB-CZ 4.11Å; D325-F330 WeakPolarHBondContact OD1-CZ 3.13Å
326	Y	86.4	Confident	89.4	Confident	111 Å²	111	61.4 Å²	61.4	44%	0.435	31%	0.309	S	S	.	.			trans	-78.6	133.2	178.3	-64.1	-20.2	0	0	0	111.5	A324 E328 S329 F330 F357	A324-Y326 HydrophobicContact CB-CD1 4.13Å; A324-Y326 HydrophobicContact CB-CD2 4.07Å; A324-Y326 HydrophobicContact CB-CE1 4.06Å; A324-Y326 HydrophobicContact CB-CE2 3.98Å; A324-Y326 HydrophobicContact CB-CG 4.12Å; A324-Y326 PolarHBondContact O-N 3.47Å; Y326-E328 PolarHBondContact O-N 3.23Å; Y326-E328 VanDerWaalsContact O-N 3.13Å; Y326-S329 WeakPolarHBondContact O-CB 3.49Å; Y326-S329 PolarHBondContact O-N 2.89Å; Y326-F330 VanDerWaalsContact O-CD2 3.29Å; Y326-F330 WeakPolarHBondContact O-CD2 3.4Å; Y326-F330 PolarHBondContact O-N 2.83Å; Y326-F357 HydrophobicContact CD2-CB 4Å; Y326-F357 AromaticContact CD2-CD1 3.97Å; Y326-F357 HydrophobicContact CD2-CD1 3.97Å; Y326-F357 AromaticContact CD2-CD2 3.4Å; Y326-F357 HydrophobicContact CD2-CD2 3.4Å; Y326-F357 HydrophobicContact CD2-CE1 4.24Å; Y326-F357 AromaticContact CD2-CE2 3.72Å; Y326-F357 HydrophobicContact CD2-CE2 3.72Å; Y326-F357 AromaticContact CD2-CG 3.52Å; Y326-F357 HydrophobicContact CD2-CG 3.52Å; Y326-F357 HydrophobicContact CD2-CZ 4.11Å; Y326-F357 HydrophobicContact CE2-CB 4Å; Y326-F357 AromaticContact CE2-CD1 3.84Å; Y326-F357 HydrophobicContact CE2-CD1 3.84Å; Y326-F357 HydrophobicContact CE2-CD2 4.09Å; Y326-F357 HydrophobicContact CE2-CE1 4.27Å; Y326-F357 AromaticContact CE2-CG 3.72Å; Y326-F357 HydrophobicContact CE2-CG 3.72Å; Y326-F357 HydrophobicContact CG-CD2 4.34Å
327	K	78.6	Confident	89.6	Confident	172 Å²	172	63.5 Å²	63.5	75%	0.748	31%	0.31	S	S	*	.	H	α-helix	trans	-54.9	-33.2	178.1	-169.6	178.2	179.9	-177.8	0	112.9	S329 N331	K327-S329 VanDerWaalsContact C-N 3.33Å; K327-S329 PolarHBondContact O-N 3.08Å; K327-N331 PolarHBondContact O-N 2.92Å; K327-N331 PolarHBondContact O-ND2 3.44Å; K327-N331 PolarHBondContact O-OD1 2.74Å
328	E	73.6	Confident	89.8	Confident	101 Å²	101	60.3 Å²	60.3	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-38.7	176.2	-170.1	-176.7	173.1	0	0	112.1	Y326 K355	Y326-E328 PolarHBondContact O-N 3.23Å; Y326-E328 VanDerWaalsContact O-N 3.13Å; E328-K355 WeakPolarHBondContact OE1-CD 3.44Å; E328-K355 IonicContact OE1-NZ 3.38Å; E328-K355 PolarHBondContact OE1-NZ 2.95Å; E328-K355 IonicContact OE2-NZ 3.76Å
329	S	72.9	Confident	89.8	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-70.8	-48.6	180	-68.7	0	0	0	0	112.6	Y326 K327 N331 T332 I333 K355 F357	Y326-S329 WeakPolarHBondContact O-CB 3.49Å; Y326-S329 PolarHBondContact O-N 2.89Å; K327-S329 VanDerWaalsContact C-N 3.33Å; K327-S329 PolarHBondContact O-N 3.08Å; S329-N331 PolarHBondContact O-N 3.03Å; S329-N331 VanDerWaalsContact O-N 3.1Å; S329-T332 PolarHBondContact O-N 2.97Å; S329-T332 PolarHBondContact O-OG1 3.13Å; S329-I333 WeakPolarHBondContact O-CG1 3.32Å; S329-I333 PolarHBondContact O-N 3.14Å; S329-I333 VanDerWaalsContact O-N 3.14Å; S329-K355 VanDerWaalsContact CA-O 3.22Å; S329-K355 WeakPolarHBondContact CA-O 3.35Å; S329-K355 WeakPolarHBondContact CB-O 3.23Å; S329-K355 PolarHBondContact OG-O 3.38Å; S329-F357 VanDerWaalsContact OG-CD2 3.24Å; S329-F357 WeakPolarHBondContact OG-CD2 3.48Å
330	F	78.6	Confident	89.7	Confident	95 Å²	95	57.6 Å²	57.6	42%	0.417	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-14.1	-178.2	-69	-76.7	0	0	0	114.9	D325 Y326 I336	D325-F330 HydrophobicContact CB-CE2 3.74Å; D325-F330 HydrophobicContact CB-CZ 4.11Å; D325-F330 WeakPolarHBondContact OD1-CZ 3.13Å; Y326-F330 VanDerWaalsContact O-CD2 3.29Å; Y326-F330 WeakPolarHBondContact O-CD2 3.4Å; Y326-F330 PolarHBondContact O-N 2.83Å; F330-I336 HydrophobicContact CD1-CD1 3.57Å; F330-I336 HydrophobicContact CE1-CD1 3.27Å; F330-I336 HydrophobicContact CZ-CD1 4.26Å
331	N	82.1	Confident	89.7	Confident	115 Å²	115	58.5 Å²	58.5	62%	0.615	29%	0.29	S	S	*	.	H	α-helix	trans	-74.6	-30.1	173.5	-66.4	-23.1	0	0	0	112	K327 S329	K327-N331 PolarHBondContact O-N 2.92Å; K327-N331 PolarHBondContact O-ND2 3.44Å; K327-N331 PolarHBondContact O-OD1 2.74Å; S329-N331 PolarHBondContact O-N 3.03Å; S329-N331 VanDerWaalsContact O-N 3.1Å
332	T	85	Confident	89.7	Confident	32 Å²	32	58.5 Å²	58.5	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-105.8	-14.6	-172.3	62.2	0	0	0	0	113.2	S329 E353 K355	S329-T332 PolarHBondContact O-N 2.97Å; S329-T332 PolarHBondContact O-OG1 3.13Å; T332-E353 WeakPolarHBondContact CB-O 3.44Å; T332-E353 WeakPolarHBondContact CG2-O 3.31Å; T332-K355 PolarHBondContact OG1-N 2.89Å
333	I	92.1	Very high	89.7	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.7	-179.9	78.9	-163.4	0	0	0	111.3	I323 S329 I336 F346 T347 W348 A354 I356	I323-I333 HydrophobicContact CD1-CD1 4.11Å; S329-I333 WeakPolarHBondContact O-CG1 3.32Å; S329-I333 PolarHBondContact O-N 3.14Å; S329-I333 VanDerWaalsContact O-N 3.14Å; I333-I336 HydrophobicContact CD1-CD1 3.87Å; I333-I336 HydrophobicContact CD1-CG1 4.2Å; I333-I336 HydrophobicContact CG1-CD1 3.92Å; I333-I336 HydrophobicContact CG1-CG1 4.17Å; I333-F346 HydrophobicContact CB-CD2 4Å; I333-F346 HydrophobicContact CG2-CD2 3.89Å; I333-F346 HydrophobicContact CG2-CE2 4.17Å; I333-T347 CarbonylContact C-O 3.51Å; I333-T347 VanDerWaalsContact CA-O 3.23Å; I333-T347 WeakPolarHBondContact CA-O 3.49Å; I333-W348 HydrophobicContact CG2-CB 4.34Å; I333-A354 HydrophobicContact CG2-CB 3.87Å; I333-I356 HydrophobicContact CD1-CG2 3.48Å; I333-I356 VanDerWaalsContact CD1-CG2 3.48Å; I333-I356 HydrophobicContact CG2-CG2 3.92Å
334	G	91.6	Very high	89.8	Confident	27 Å²	27	55.7 Å²	55.7	28%	0.278	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	177.2	174.6	0	0	0	0	0	112.4	I336 T347	G334-I336 VanDerWaalsContact C-N 3.32Å; G334-I336 PolarHBondContact O-N 2.96Å; G334-T347 VanDerWaalsContact C-OG1 3.25Å; G334-T347 PolarHBondContact N-O 2.72Å; G334-T347 PolarHBondContact O-N 2.73Å; G334-T347 PolarHBondContact O-OG1 3.23Å
335	N	91.9	Very high	89.9	Confident	91 Å²	91	55.4 Å²	55.4	49%	0.487	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.6	48.7	178.8	-62.3	92.4	0	0	0	113.1	E337 T347	N335-E337 PolarHBondContact O-N 2.94Å; N335-T347 HydrophobicContact CB-CG2 3.89Å; N335-T347 PolarHBondContact OD1-OG1 3.15Å
336	I	94.5	Very high	90.3	Very high	54 Å²	54	49.2 Å²	49.2	28%	0.277	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	125.2	178.2	-61.4	154.8	0	0	0	108.7	I323 F330 I333 G334 I344 S345 F346	I323-I336 HydrophobicContact CG2-CG2 4.31Å; F330-I336 HydrophobicContact CD1-CD1 3.57Å; F330-I336 HydrophobicContact CE1-CD1 3.27Å; F330-I336 HydrophobicContact CZ-CD1 4.26Å; I333-I336 HydrophobicContact CD1-CD1 3.87Å; I333-I336 HydrophobicContact CD1-CG1 4.2Å; I333-I336 HydrophobicContact CG1-CD1 3.92Å; I333-I336 HydrophobicContact CG1-CG1 4.17Å; G334-I336 VanDerWaalsContact C-N 3.32Å; G334-I336 PolarHBondContact O-N 2.96Å; I336-I344 HydrophobicContact CG2-CG2 3.98Å; I336-S345 CarbonylContact C-O 3.49Å; I336-S345 VanDerWaalsContact CA-O 3.32Å; I336-S345 WeakPolarHBondContact CA-O 3.39Å; I336-F346 HydrophobicContact CG1-CB 3.92Å
337	E	94.5	Very high	90.7	Very high	96 Å²	96	44.2 Å²	44.2	45%	0.449	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	124.5	-178.1	-68.3	177.2	-172.7	0	0	110.2	N335 I339 S345	N335-E337 PolarHBondContact O-N 2.94Å; E337-I339 VanDerWaalsContact C-N 3.27Å; E337-I339 HydrophobicContact CB-CG2 3.91Å; E337-I339 PolarHBondContact O-N 3.3Å; E337-S345 PolarHBondContact N-O 3.19Å; E337-S345 PolarHBondContact O-N 2.86Å
338	E	95.5	Very high	91.5	Very high	96 Å²	96	36.3 Å²	36.3	45%	0.449	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	67.9	175.8	-75.6	-173.7	-165.7	0	0	111.9	R319 A340	R319-E338 VanDerWaalsContact CD-OE2 3.22Å; R319-E338 WeakPolarHBondContact CD-OE2 3.47Å; R319-E338 IonicContact CZ-OE2 3.37Å; R319-E338 IonicContact NE-OE2 3.19Å; R319-E338 PolarHBondContact NE-OE2 2.8Å; R319-E338 IonicContact NH1-OE2 3.11Å; R319-E338 PolarHBondContact NH1-OE2 3.43Å; E338-A340 PolarHBondContact O-N 3.46Å; E338-A340 VanDerWaalsContact O-N 3.15Å
339	I	94.9	Very high	92.3	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.067	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	-22.4	-169	64.2	169	0	0	0	115.3	V288 E337 A343 L459 A472	V288-I339 HydrophobicContact CG1-CD1 3.67Å; V288-I339 HydrophobicContact CG2-CD1 4.27Å; E337-I339 VanDerWaalsContact C-N 3.27Å; E337-I339 HydrophobicContact CB-CG2 3.91Å; E337-I339 PolarHBondContact O-N 3.3Å; I339-A343 HydrophobicContact CD1-CB 4.17Å; I339-A343 HydrophobicContact CG1-CB 3.89Å; I339-A343 PolarHBondContact N-O 3.24Å; I339-L459 HydrophobicContact CD1-CD1 4.27Å; I339-A472 HydrophobicContact CB-CB 3.67Å; I339-A472 HydrophobicContact CG2-CB 3.63Å
340	A	97.2	Very high	93.2	Very high	1 Å²	1	34 Å²	34	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	165.4	174.5	0	0	0	0	0	110	R319 E338 N342 A343 L459 I461	R319-A340 PolarHBondContact NH1-O 3.5Å; R319-A340 PolarHBondContact NH2-O 2.98Å; E338-A340 PolarHBondContact O-N 3.46Å; E338-A340 VanDerWaalsContact O-N 3.15Å; A340-N342 PolarHBondContact O-N 2.97Å; A340-A343 HydrophobicContact CB-CB 4.07Å; A340-A343 PolarHBondContact N-O 3.05Å; A340-A343 PolarHBondContact O-N 3.49Å; A340-A343 VanDerWaalsContact O-N 3.15Å; A340-L459 HydrophobicContact CB-CB 3.86Å; A340-L459 HydrophobicContact CB-CD2 4.39Å; A340-L459 HydrophobicContact CB-CG 4.49Å; A340-I461 HydrophobicContact CB-CG1 4.03Å
341	Y	97.7	Very high	93.6	Very high	18 Å²	18	33.9 Å²	33.9	7%	0.071	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.3	179.6	-89.4	-128.9	0	0	0	113	H310 A316 Q318 R319 V320 L321 F460 P462 H465	H310-Y341 AromaticContact CD2-CE1 3.95Å; H310-Y341 AromaticContact NE2-CE1 3.63Å; A316-Y341 WeakPolarHBondContact O-CE1 3.32Å; A316-Y341 PolarHBondContact O-OH 3.1Å; Q318-Y341 VanDerWaalsContact O-CD1 3.3Å; Q318-Y341 WeakPolarHBondContact O-CD1 3.16Å; Q318-Y341 WeakPolarHBondContact O-CE1 3.34Å; R319-Y341 HydrophobicContact CG-CD1 4.27Å; R319-Y341 HydrophobicContact CG-CE1 4.43Å; R319-Y341 HydrophobicContact CG-CG 4.43Å; V320-Y341 WeakPolarHBondContact CA-O 3.31Å; V320-Y341 WeakPolarHBondContact CB-O 3.46Å; V320-Y341 PolarHBondContact N-O 2.91Å; L321-Y341 PolarHBondContact N-O 2.89Å; L321-Y341 VanDerWaalsContact N-O 3.14Å; Y341-F460 HydrophobicContact CG-CD1 4.48Å; Y341-F460 PolarHBondContact N-O 2.86Å; Y341-P462 HydrophobicContact CD1-CG 4.04Å; Y341-P462 HydrophobicContact CD2-CG 3.79Å; Y341-P462 HydrophobicContact CE1-CG 3.79Å; Y341-P462 HydrophobicContact CE2-CG 3.52Å; Y341-P462 HydrophobicContact CG-CG 4.05Å; Y341-H465 PolarHBondContact OH-CE1 3.14Å; Y341-H465 PolarHBondContact OH-ND1 3.14Å; Y341-H465 PolarHBondContact OH-NE2 3.02Å
342	N	98.2	Very high	94	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	11.1	177.1	70	-44.3	0	0	0	113.8	M290 V291 W306 V320 A340 V458 F460	M290-N342 CarbonylContact C-O 3.56Å; M290-N342 WeakPolarHBondContact CA-O 3.31Å; M290-N342 WeakPolarHBondContact CB-O 3.48Å; V291-N342 PolarHBondContact N-O 3.05Å; V291-N342 PolarHBondContact O-ND2 3.29Å; W306-N342 HydrophobicContact CZ2-CB 4.41Å; V320-N342 HydrophobicContact CB-CB 3.95Å; V320-N342 HydrophobicContact CG1-CB 4.11Å; V320-N342 HydrophobicContact CG2-CB 4.29Å; A340-N342 PolarHBondContact O-N 2.97Å; N342-V458 PolarHBondContact ND2-O 2.97Å; N342-V458 VanDerWaalsContact ND2-O 3.12Å; N342-F460 PolarHBondContact OD1-N 2.87Å
343	A	98.3	Very high	94.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	144.4	-178.8	0	0	0	0	0	113.8	V288 I289 M290 R319 I339 A340 L459	V288-A343 HydrophobicContact CG1-CB 4.24Å; I289-A343 CarbonylContact O-C 3.55Å; I289-A343 VanDerWaalsContact O-CA 3.28Å; I289-A343 WeakPolarHBondContact O-CA 3.35Å; M290-A343 HydrophobicContact CB-CB 3.79Å; R319-A343 PolarHBondContact NH2-O 2.98Å; I339-A343 HydrophobicContact CD1-CB 4.17Å; I339-A343 HydrophobicContact CG1-CB 3.89Å; I339-A343 PolarHBondContact N-O 3.24Å; A340-A343 HydrophobicContact CB-CB 4.07Å; A340-A343 PolarHBondContact N-O 3.05Å; A340-A343 PolarHBondContact O-N 3.49Å; A340-A343 VanDerWaalsContact O-N 3.15Å; A343-L459 HydrophobicContact CB-CD2 3.65Å
344	I	98.2	Very high	94.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.6	177.7	-56.4	175.8	0	0	0	107.9	V288 I289 L321 I323 I336	V288-I344 CarbonylContact C-O 3.56Å; V288-I344 WeakPolarHBondContact CA-O 3.39Å; I289-I344 HydrophobicContact CG2-CB 4.01Å; I289-I344 PolarHBondContact N-O 2.88Å; I289-I344 PolarHBondContact O-N 3.26Å; L321-I344 HydrophobicContact CD2-CD1 4.38Å; L321-I344 HydrophobicContact CD2-CG1 4.25Å; L321-I344 HydrophobicContact CG-CD1 4.01Å; L321-I344 HydrophobicContact CG-CG1 4.32Å; I323-I344 HydrophobicContact CB-CD1 3.75Å; I323-I344 HydrophobicContact CG2-CD1 3.95Å; I336-I344 HydrophobicContact CG2-CG2 3.98Å
345	S	96.9	Very high	94.6	Very high	1 Å²	1	38 Å²	38	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.5	174	178.1	0	0	0	0	109.4	R286 S287 I336 E337	R286-S345 PolarHBondContact NH1-OG 3.47Å; S287-S345 CarbonylContact O-C 3.6Å; S287-S345 WeakPolarHBondContact O-CA 3.48Å; I336-S345 CarbonylContact C-O 3.49Å; I336-S345 VanDerWaalsContact CA-O 3.32Å; I336-S345 WeakPolarHBondContact CA-O 3.39Å; E337-S345 PolarHBondContact N-O 3.19Å; E337-S345 PolarHBondContact O-N 2.86Å
346	F	96.6	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	164.7	172.2	58.1	-86.5	0	0	0	109.9	L269 R286 S287 I289 I333 I336 W348 I356	L269-F346 HydrophobicContact CD1-CE2 4.27Å; L269-F346 HydrophobicContact CD1-CZ 3.95Å; L269-F346 HydrophobicContact CD2-CE2 4.2Å; L269-F346 HydrophobicContact CD2-CZ 3.89Å; R286-F346 CarbonylContact C-O 3.55Å; R286-F346 WeakPolarHBondContact CA-O 3.16Å; S287-F346 PolarHBondContact N-O 3.35Å; S287-F346 PolarHBondContact O-N 2.94Å; I289-F346 HydrophobicContact CB-CE1 4.41Å; I289-F346 HydrophobicContact CG2-CE1 3.92Å; I333-F346 HydrophobicContact CB-CD2 4Å; I333-F346 HydrophobicContact CG2-CD2 3.89Å; I333-F346 HydrophobicContact CG2-CE2 4.17Å; I336-F346 HydrophobicContact CG1-CB 3.92Å; F346-W348 AromaticContact CE2-CD1 3.77Å; F346-W348 HydrophobicContact CE2-CG 4.5Å; F346-I356 HydrophobicContact CE1-CD1 3.62Å; F346-I356 HydrophobicContact CE1-CG2 4.4Å; F346-I356 HydrophobicContact CE2-CG2 4.14Å; F346-I356 HydrophobicContact CZ-CD1 3.71Å; F346-I356 HydrophobicContact CZ-CG2 4.08Å
347	T	95.4	Very high	95	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.037	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.8	177.6	61.9	0	0	0	0	110.4	V285 R286 I333 G334 N335 Y387	V285-T347 CarbonylContact O-C 3.58Å; V285-T347 WeakPolarHBondContact O-CA 3.37Å; V285-T347 WeakPolarHBondContact O-CB 3.49Å; R286-T347 HydrophobicContact CB-CG2 4.13Å; R286-T347 HydrophobicContact CG-CG2 4.17Å; I333-T347 CarbonylContact C-O 3.51Å; I333-T347 VanDerWaalsContact CA-O 3.23Å; I333-T347 WeakPolarHBondContact CA-O 3.49Å; G334-T347 VanDerWaalsContact C-OG1 3.25Å; G334-T347 PolarHBondContact N-O 2.72Å; G334-T347 PolarHBondContact O-N 2.73Å; G334-T347 PolarHBondContact O-OG1 3.23Å; N335-T347 HydrophobicContact CB-CG2 3.89Å; N335-T347 PolarHBondContact OD1-OG1 3.15Å; T347-Y387 HydrophobicContact CG2-CD2 3.79Å; T347-Y387 HydrophobicContact CG2-CE2 3.67Å
348	W	95	Very high	95.1	Very high	5 Å²	5	28 Å²	28	2%	0.019	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	161.7	178.3	59.9	-76.7	0	0	0	110.8	F237 L269 K284 V285 S287 I333 F346 V350 A354	F237-W348 AromaticContact CD1-CH2 3.91Å; F237-W348 HydrophobicContact CD1-CH2 3.91Å; F237-W348 AromaticContact CD1-CZ2 3.95Å; F237-W348 HydrophobicContact CD1-CZ2 3.95Å; F237-W348 AromaticContact CE1-CH2 3.96Å; F237-W348 HydrophobicContact CE1-CH2 3.96Å; F237-W348 AromaticContact CE1-CZ2 3.97Å; F237-W348 HydrophobicContact CE1-CZ2 3.97Å; L269-W348 HydrophobicContact CB-CH2 4.2Å; L269-W348 HydrophobicContact CB-CZ2 3.93Å; L269-W348 HydrophobicContact CD2-CZ2 4.42Å; K284-W348 WeakPolarHBondContact CA-O 3.34Å; V285-W348 HydrophobicContact CG2-CD2 3.82Å; V285-W348 HydrophobicContact CG2-CG 4.13Å; V285-W348 HydrophobicContact CG2-CH2 4.39Å; V285-W348 HydrophobicContact CG2-CZ2 3.69Å; V285-W348 PolarHBondContact N-O 2.83Å; V285-W348 PolarHBondContact O-N 2.86Å; S287-W348 PolarHBondContact OG-NE1 3.12Å; I333-W348 HydrophobicContact CG2-CB 4.34Å; F346-W348 AromaticContact CE2-CD1 3.77Å; F346-W348 HydrophobicContact CE2-CG 4.5Å; W348-V350 HydrophobicContact CH2-CG1 4.43Å; W348-V350 HydrophobicContact CZ3-CG1 4.44Å; W348-A354 HydrophobicContact CB-CB 3.61Å; W348-A354 HydrophobicContact CD2-CB 3.69Å; W348-A354 HydrophobicContact CE3-CB 3.74Å; W348-A354 HydrophobicContact CG-CB 3.65Å
349	D	91.5	Very high	95.3	Very high	37 Å²	37	23.7 Å²	23.7	20%	0.198	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.6	178.2	-166.2	-53.1	0	0	0	110.3	S283 N351 E352	S283-D349 VanDerWaalsContact CB-OD1 3.3Å; S283-D349 WeakPolarHBondContact CB-OD1 3.24Å; S283-D349 VanDerWaalsContact CB-OD2 3.3Å; S283-D349 WeakPolarHBondContact CB-OD2 3.43Å; S283-D349 WeakPolarHBondContact O-CA 3.01Å; S283-D349 PolarHBondContact OG-OD2 3.15Å; D349-N351 PolarHBondContact O-N 3.17Å; D349-N351 VanDerWaalsContact OD1-CB 3.26Å; D349-N351 WeakPolarHBondContact OD1-CB 3.01Å; D349-N351 PolarHBondContact OD1-N 3.31Å; D349-N351 PolarHBondContact OD1-ND2 2.7Å; D349-E352 PolarHBondContact O-N 2.77Å; D349-E352 VanDerWaalsContact O-O 3.05Å
350	V	90.6	Very high	95.4	Very high	18 Å²	18	23.1 Å²	23.1	11%	0.109	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.7	-177.8	-58.5	0	0	0	0	114.3	F237 E271 S283 V285 W348 E352	F237-V350 HydrophobicContact CE1-CG1 4.02Å; F237-V350 HydrophobicContact CZ-CG1 4.42Å; E271-V350 HydrophobicContact CB-CB 4.09Å; E271-V350 VanDerWaalsContact OE2-CB 3.29Å; E271-V350 WeakPolarHBondContact OE2-CB 3.36Å; E271-V350 WeakPolarHBondContact OE2-CG2 3.24Å; S283-V350 WeakPolarHBondContact O-CG2 3.4Å; S283-V350 PolarHBondContact O-N 3.31Å; V285-V350 HydrophobicContact CB-CG1 4.3Å; V285-V350 HydrophobicContact CG1-CG1 3.64Å; V285-V350 HydrophobicContact CG2-CG1 3.68Å; W348-V350 HydrophobicContact CH2-CG1 4.43Å; W348-V350 HydrophobicContact CZ3-CG1 4.44Å; V350-E352 VanDerWaalsContact C-N 3.28Å
351	N	88.1	Confident	95.5	Very high	92 Å²	92	23.6 Å²	23.6	49%	0.492	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-19.2	174.9	-59.5	-61.5	0	0	0	112.3	S283 D349	S283-N351 VanDerWaalsContact CB-ND2 3.3Å; S283-N351 WeakPolarHBondContact CB-ND2 3.37Å; D349-N351 PolarHBondContact O-N 3.17Å; D349-N351 VanDerWaalsContact OD1-CB 3.26Å; D349-N351 WeakPolarHBondContact OD1-CB 3.01Å; D349-N351 PolarHBondContact OD1-N 3.31Å; D349-N351 PolarHBondContact OD1-ND2 2.7Å
352	E	89.7	Confident	95.5	Very high	108 Å²	108	22.8 Å²	22.8	51%	0.505	11%	0.112	S	C	.	.	S	Bend	trans	-107.7	162.3	177.4	-63.1	-174	178.9	0	0	110.6	D349 V350	D349-E352 PolarHBondContact O-N 2.77Å; D349-E352 VanDerWaalsContact O-O 3.05Å; V350-E352 VanDerWaalsContact C-N 3.28Å
353	E	92.1	Very high	95.5	Very high	108 Å²	108	24 Å²	24	51%	0.505	12%	0.118	S	C	.	.			trans	-88.9	120.8	170.2	-174.9	177.5	119.9	0	0	108.6	T268 T332	T268-E353 HydrophobicContact CG2-CG 3.39Å; T268-E353 WeakPolarHBondContact CG2-OE1 3.49Å; T268-E353 PolarHBondContact OG1-OE1 2.98Å; T332-E353 WeakPolarHBondContact CB-O 3.44Å; T332-E353 WeakPolarHBondContact CG2-O 3.31Å
354	A	94.8	Very high	95.3	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.6	174	0	0	0	0	0	109.9	T268 L269 I333 W348	T268-A354 CarbonylContact C-O 3.56Å; T268-A354 WeakPolarHBondContact CA-O 3.36Å; L269-A354 HydrophobicContact CB-CB 4.23Å; L269-A354 HydrophobicContact CD1-CB 4.45Å; L269-A354 PolarHBondContact N-O 2.82Å; L269-A354 PolarHBondContact O-N 3.14Å; I333-A354 HydrophobicContact CG2-CB 3.87Å; W348-A354 HydrophobicContact CB-CB 3.61Å; W348-A354 HydrophobicContact CD2-CB 3.69Å; W348-A354 HydrophobicContact CE3-CB 3.74Å; W348-A354 HydrophobicContact CG-CB 3.65Å
355	K	95.5	Very high	95.2	Very high	53 Å²	53	27.1 Å²	27.1	23%	0.23	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	118	-179.6	-171.5	176.4	175.7	-168.4	0	110.8	V267 E328 S329 T332 F357	V267-K355 WeakPolarHBondContact O-CA 3.42Å; E328-K355 WeakPolarHBondContact OE1-CD 3.44Å; E328-K355 IonicContact OE1-NZ 3.38Å; E328-K355 PolarHBondContact OE1-NZ 2.95Å; E328-K355 IonicContact OE2-NZ 3.76Å; S329-K355 VanDerWaalsContact CA-O 3.22Å; S329-K355 WeakPolarHBondContact CA-O 3.35Å; S329-K355 WeakPolarHBondContact CB-O 3.23Å; S329-K355 PolarHBondContact OG-O 3.38Å; T332-K355 PolarHBondContact OG1-N 2.89Å; K355-F357 HydrophobicContact CD-CZ 4.43Å; K355-F357 HydrophobicContact CG-CE2 4.29Å
356	I	96.7	Very high	95.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154.9	179	68.5	177.6	0	0	0	110	A266 V267 L269 I289 I323 I333 F346 I358	A266-I356 CarbonylContact C-O 3.48Å; A266-I356 WeakPolarHBondContact CA-O 3.32Å; V267-I356 HydrophobicContact CB-CD1 4.29Å; V267-I356 HydrophobicContact CB-CG1 3.75Å; V267-I356 HydrophobicContact CG1-CD1 4.46Å; V267-I356 HydrophobicContact CG1-CG1 4.31Å; V267-I356 PolarHBondContact N-O 3.2Å; V267-I356 PolarHBondContact O-N 2.88Å; L269-I356 HydrophobicContact CD1-CD1 4.47Å; L269-I356 HydrophobicContact CD1-CG1 4.49Å; I289-I356 HydrophobicContact CD1-CD1 3.9Å; I289-I356 HydrophobicContact CG2-CD1 4.1Å; I323-I356 HydrophobicContact CD1-CB 4.13Å; I323-I356 HydrophobicContact CD1-CG2 4.25Å; I333-I356 HydrophobicContact CD1-CG2 3.48Å; I333-I356 VanDerWaalsContact CD1-CG2 3.48Å; I333-I356 HydrophobicContact CG2-CG2 3.92Å; F346-I356 HydrophobicContact CE1-CD1 3.62Å; F346-I356 HydrophobicContact CE1-CG2 4.4Å; F346-I356 HydrophobicContact CE2-CG2 4.14Å; F346-I356 HydrophobicContact CZ-CD1 3.71Å; F346-I356 HydrophobicContact CZ-CG2 4.08Å; I356-I358 HydrophobicContact CD1-CG2 3.85Å; I356-I358 HydrophobicContact CG1-CG2 4.14Å
357	F	97.3	Very high	95.1	Very high	29 Å²	29	29.1 Å²	29.1	13%	0.127	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.6	173.1	-63.7	-100.8	0	0	0	108.3	F264 Y265 A266 I323 A324 Y326 S329 K355	F264-F357 HydrophobicContact CB-CB 4.42Å; F264-F357 HydrophobicContact CD1-CB 4.44Å; Y265-F357 WeakPolarHBondContact O-CA 3.47Å; A266-F357 HydrophobicContact CB-CD1 3.88Å; A266-F357 HydrophobicContact CB-CE1 3.7Å; A266-F357 HydrophobicContact CB-CZ 4.35Å; I323-F357 CarbonylContact C-O 3.5Å; I323-F357 WeakPolarHBondContact CA-O 3.42Å; A324-F357 HydrophobicContact CB-CB 3.88Å; A324-F357 PolarHBondContact N-O 3.31Å; Y326-F357 HydrophobicContact CD2-CB 4Å; Y326-F357 AromaticContact CD2-CD1 3.97Å; Y326-F357 HydrophobicContact CD2-CD1 3.97Å; Y326-F357 AromaticContact CD2-CD2 3.4Å; Y326-F357 HydrophobicContact CD2-CD2 3.4Å; Y326-F357 HydrophobicContact CD2-CE1 4.24Å; Y326-F357 AromaticContact CD2-CE2 3.72Å; Y326-F357 HydrophobicContact CD2-CE2 3.72Å; Y326-F357 AromaticContact CD2-CG 3.52Å; Y326-F357 HydrophobicContact CD2-CG 3.52Å; Y326-F357 HydrophobicContact CD2-CZ 4.11Å; Y326-F357 HydrophobicContact CE2-CB 4Å; Y326-F357 AromaticContact CE2-CD1 3.84Å; Y326-F357 HydrophobicContact CE2-CD1 3.84Å; Y326-F357 HydrophobicContact CE2-CD2 4.09Å; Y326-F357 HydrophobicContact CE2-CE1 4.27Å; Y326-F357 AromaticContact CE2-CG 3.72Å; Y326-F357 HydrophobicContact CE2-CG 3.72Å; Y326-F357 HydrophobicContact CG-CD2 4.34Å; S329-F357 VanDerWaalsContact OG-CD2 3.24Å; S329-F357 WeakPolarHBondContact OG-CD2 3.48Å; K355-F357 HydrophobicContact CD-CZ 4.43Å; K355-F357 HydrophobicContact CG-CE2 4.29Å
358	I	97.9	Very high	94.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	153.3	-175.6	57.2	154.5	0	0	0	111.4	F264 Y265 V267 I289 L321 D322 I356 I380	F264-I358 CarbonylContact C-O 3.54Å; F264-I358 WeakPolarHBondContact CA-O 3.34Å; Y265-I358 PolarHBondContact N-O 3.36Å; Y265-I358 PolarHBondContact O-N 3.22Å; V267-I358 HydrophobicContact CG2-CD1 3.86Å; V267-I358 HydrophobicContact CG2-CG1 3.8Å; I289-I358 HydrophobicContact CD1-CD1 3.68Å; I289-I358 HydrophobicContact CD1-CG1 4.49Å; I289-I358 HydrophobicContact CD1-CG2 4.27Å; L321-I358 HydrophobicContact CD1-CB 3.98Å; L321-I358 HydrophobicContact CD1-CD1 3.97Å; L321-I358 HydrophobicContact CD1-CG2 4.39Å; D322-I358 CarbonylContact O-C 3.59Å; D322-I358 VanDerWaalsContact O-CA 3.24Å; D322-I358 WeakPolarHBondContact O-CA 3.22Å; I356-I358 HydrophobicContact CD1-CG2 3.85Å; I356-I358 HydrophobicContact CG1-CG2 4.14Å; I358-I380 HydrophobicContact CD1-CD1 3.84Å
359	T	98.1	Very high	94.5	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.4	168.1	-167.4	0	0	0	0	111.6	G262 Q263 F264 L321 D322	G262-T359 WeakPolarHBondContact CA-OG1 3.34Å; G262-T359 PolarHBondContact N-OG1 2.87Å; Q263-T359 PolarHBondContact N-OG1 2.86Å; Q263-T359 VanDerWaalsContact O-CB 3.23Å; Q263-T359 WeakPolarHBondContact O-CB 3.36Å; Q263-T359 PolarHBondContact O-OG1 2.9Å; F264-T359 HydrophobicContact CD1-CG2 4.13Å; F264-T359 HydrophobicContact CE1-CG2 3.63Å; F264-T359 HydrophobicContact CE2-CG2 4.4Å; F264-T359 HydrophobicContact CZ-CG2 3.79Å; L321-T359 WeakPolarHBondContact CA-O 3.42Å; L321-T359 WeakPolarHBondContact CD1-O 3.13Å; D322-T359 HydrophobicContact CB-CG2 3.77Å; D322-T359 PolarHBondContact N-O 2.91Å; D322-T359 VanDerWaalsContact N-O 3.15Å; D322-T359 PolarHBondContact O-N 3.08Å
360	V	98.5	Very high	94.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.8	177.6	-175.8	0	0	0	0	109	L259 K261 G262 V291 V320 L321 I380 I402 V404	L259-V360 HydrophobicContact CD1-CG2 4.13Å; K261-V360 WeakPolarHBondContact CA-O 3.47Å; G262-V360 PolarHBondContact N-O 3.34Å; V291-V360 HydrophobicContact CG1-CG1 4.35Å; V291-V360 HydrophobicContact CG2-CG1 4.14Å; V291-V360 HydrophobicContact CG2-CG2 3.91Å; V320-V360 WeakPolarHBondContact O-CA 3.05Å; L321-V360 HydrophobicContact CD1-CG2 4.34Å; V360-I380 HydrophobicContact CG2-CD1 4.45Å; V360-I402 HydrophobicContact CG1-CD1 4.33Å; V360-I402 HydrophobicContact CG2-CD1 4.17Å; V360-V404 HydrophobicContact CB-CG2 4.22Å; V360-V404 HydrophobicContact CG1-CG2 3.81Å
361	N	98.1	Very high	94.1	Very high	11 Å²	11	48.8 Å²	48.8	6%	0.059	25%	0.25	C	C	.	.			trans	-101.9	0.3	-169.2	-65.3	-43.2	0	0	0	114.5	K261 W309 Q318 R319 V320 D322	K261-N361 WeakPolarHBondContact CD-O 3.34Å; K261-N361 WeakPolarHBondContact CE-O 3.4Å; K261-N361 PolarHBondContact NZ-O 3.38Å; W309-N361 HydrophobicContact CZ2-CB 4.48Å; Q318-N361 PolarHBondContact NE2-ND2 3.35Å; Q318-N361 VanDerWaalsContact NE2-ND2 3.16Å; R319-N361 WeakPolarHBondContact O-CB 3.04Å; R319-N361 PolarHBondContact O-ND2 2.86Å; V320-N361 PolarHBondContact O-N 3.44Å; D322-N361 PolarHBondContact OD2-ND2 3.29Å
362	C	97.9	Very high	93.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.27	C	S	.	.			trans	-103.9	131.5	173.6	63.2	0	0	0	0	111.3	W309 V320 F367 V404	W309-C362 HydrophobicContact CD2-CB 4.44Å; W309-C362 HydrophobicContact CG-CB 4.39Å; W309-C362 HydrophobicContact CZ2-CB 4.34Å; V320-C362 HydrophobicContact CG1-CB 4.49Å; C362-F367 HydrophobicContact CB-CE2 4.45Å; C362-F367 HydrophobicContact CB-CZ 3.91Å; C362-V404 WeakPolarHBondContact O-CB 3.34Å; C362-V404 VanDerWaalsContact O-CG1 3.26Å; C362-V404 WeakPolarHBondContact O-CG1 3.48Å
363	L	97.4	Very high	93.6	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.131	26%	0.259	C	S	.	.			trans	-73.9	148.7	166.9	-52.1	178.9	0	0	0	109.3	K261 T365 D366 V404 F405 C406	K261-L363 HydrophobicContact CB-CD2 3.71Å; K261-L363 HydrophobicContact CD-CD2 3.84Å; K261-L363 HydrophobicContact CD-CG 4.15Å; K261-L363 HydrophobicContact CG-CD2 4.32Å; L363-T365 PolarHBondContact O-N 2.86Å; L363-D366 HydrophobicContact CB-CB 4.38Å; L363-D366 VanDerWaalsContact CB-CG 3.5Å; L363-D366 WeakPolarHBondContact CB-OD1 3.42Å; L363-D366 WeakPolarHBondContact CB-OD2 3.39Å; L363-D366 PolarHBondContact N-OD2 2.99Å; L363-D366 WeakPolarHBondContact O-CB 3.48Å; L363-D366 PolarHBondContact O-N 3.42Å; L363-V404 HydrophobicContact CD2-CG1 4.41Å; L363-F405 VanDerWaalsContact CD2-C 3.42Å; L363-C406 HydrophobicContact CD1-CB 4.17Å; L363-C406 HydrophobicContact CD2-CB 4.03Å
364	S	95.9	Very high	93.3	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.021	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.8	174.3	-60.4	0	0	0	0	112.5	G375 L376 V404	S364-G375 CarbonylContact O-C 3.3Å; S364-G375 VanDerWaalsContact O-C 3.3Å; S364-G375 WeakPolarHBondContact O-CA 3.41Å; S364-L376 PolarHBondContact O-N 3.4Å; S364-V404 PolarHBondContact N-O 2.92Å; S364-V404 PolarHBondContact OG-N 2.84Å; S364-V404 VanDerWaalsContact OG-N 3.1Å
365	T	96.1	Very high	93	Very high	64 Å²	64	49.2 Å²	49.2	39%	0.393	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.7	177.8	52.2	0	0	0	0	114.6	L363 F367 V373	L363-T365 PolarHBondContact O-N 2.86Å; T365-F367 PolarHBondContact O-N 3.25Å; T365-V373 HydrophobicContact CG2-CG2 4.44Å
366	D	96.1	Very high	92.9	Very high	34 Å²	34	48.6 Å²	48.6	18%	0.182	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.7	-173.5	-75	-16.2	0	0	0	113.8	Y308 L363 S368	Y308-D366 VanDerWaalsContact CE1-O 3.24Å; Y308-D366 WeakPolarHBondContact CE1-O 3.44Å; L363-D366 HydrophobicContact CB-CB 4.38Å; L363-D366 VanDerWaalsContact CB-CG 3.5Å; L363-D366 WeakPolarHBondContact CB-OD1 3.42Å; L363-D366 WeakPolarHBondContact CB-OD2 3.39Å; L363-D366 PolarHBondContact N-OD2 2.99Å; L363-D366 WeakPolarHBondContact O-CB 3.48Å; L363-D366 PolarHBondContact O-N 3.42Å; D366-S368 VanDerWaalsContact C-N 3.31Å; D366-S368 PolarHBondContact O-N 3.39Å
367	F	95.1	Very high	92.8	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.035	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.1	-175.2	-53.8	-76.4	0	0	0	114.2	F293 Y305 W306 W309 C362 T365 L376 L378	F293-F367 HydrophobicContact CE1-CD1 4.03Å; F293-F367 HydrophobicContact CE1-CD2 4.12Å; F293-F367 AromaticContact CE1-CE1 3.92Å; F293-F367 HydrophobicContact CE1-CE1 3.92Å; F293-F367 HydrophobicContact CE1-CE2 4.03Å; F293-F367 HydrophobicContact CE1-CG 4.11Å; F293-F367 AromaticContact CE1-CZ 3.91Å; F293-F367 HydrophobicContact CE1-CZ 3.91Å; F293-F367 AromaticContact CZ-CD1 3.83Å; F293-F367 HydrophobicContact CZ-CD1 3.83Å; F293-F367 AromaticContact CZ-CE1 3.62Å; F293-F367 HydrophobicContact CZ-CE1 3.62Å; F293-F367 HydrophobicContact CZ-CG 4.35Å; F293-F367 HydrophobicContact CZ-CZ 4.01Å; Y305-F367 HydrophobicContact CD1-CB 4.3Å; W306-F367 AromaticContact CE3-CE1 3.76Å; W306-F367 HydrophobicContact CE3-CE1 3.76Å; W306-F367 HydrophobicContact CE3-CZ 4.28Å; W306-F367 HydrophobicContact CH2-CE1 4.26Å; W306-F367 HydrophobicContact CH2-CZ 4.03Å; W306-F367 AromaticContact CZ3-CE1 3.58Å; W306-F367 HydrophobicContact CZ3-CE1 3.58Å; W306-F367 AromaticContact CZ3-CZ 3.63Å; W306-F367 HydrophobicContact CZ3-CZ 3.63Å; W309-F367 HydrophobicContact CB-CD1 4.02Å; W309-F367 HydrophobicContact CB-CE1 3.85Å; W309-F367 HydrophobicContact CG-CE1 4.2Å; C362-F367 HydrophobicContact CB-CE2 4.45Å; C362-F367 HydrophobicContact CB-CZ 3.91Å; T365-F367 PolarHBondContact O-N 3.25Å; F367-L376 HydrophobicContact CB-CD1 3.4Å; F367-L376 VanDerWaalsContact CB-CD1 3.4Å; F367-L376 HydrophobicContact CB-CG 4Å; F367-L376 HydrophobicContact CD2-CB 4.13Å; F367-L376 HydrophobicContact CD2-CD1 4.14Å; F367-L376 HydrophobicContact CD2-CG 4.38Å; F367-L376 HydrophobicContact CG-CD1 3.86Å; F367-L376 HydrophobicContact CG-CG 4.48Å; F367-L378 HydrophobicContact CE2-CD1 4.04Å; F367-L378 HydrophobicContact CE2-CD2 3.9Å; F367-L378 HydrophobicContact CE2-CG 4.3Å; F367-L378 HydrophobicContact CZ-CD1 4.5Å; F367-L378 HydrophobicContact CZ-CD2 4.06Å
368	S	89	Confident	92.7	Very high	49 Å²	49	49.4 Å²	49.4	34%	0.343	29%	0.286	S	S	.	.			trans	-145	146.1	173.4	178.2	0	0	0	0	110.5	D366 Q370	D366-S368 VanDerWaalsContact C-N 3.31Å; D366-S368 PolarHBondContact O-N 3.39Å; S368-Q370 VanDerWaalsContact C-N 3.27Å; S368-Q370 WeakPolarHBondContact OG-CB 3.19Å; S368-Q370 PolarHBondContact OG-N 2.82Å; S368-Q370 VanDerWaalsContact OG-N 3.15Å
369	S	87.1	Confident	92.7	Very high	92 Å²	92	50 Å²	50	64%	0.643	29%	0.289	S	S	*	.			trans	-80.2	-11.5	171.7	52.4	0	0	0	0	112.7	Y308 K371	Y308-S369 WeakPolarHBondContact OH-CA 3.48Å; Y308-S369 VanDerWaalsContact OH-CB 3.29Å; Y308-S369 WeakPolarHBondContact OH-CB 3.28Å; Y308-S369 PolarHBondContact OH-N 3.16Å; Y308-S369 VanDerWaalsContact OH-N 3.11Å; S369-K371 PolarHBondContact O-N 2.85Å
370	Q	88.9	Confident	92.6	Very high	134 Å²	134	49.8 Å²	49.8	63%	0.626	29%	0.288	S	S	*	.			trans	-72	122.6	-173.9	-164.6	177.7	24.1	0	0	110.4	S368 V373	S368-Q370 VanDerWaalsContact C-N 3.27Å; S368-Q370 WeakPolarHBondContact OG-CB 3.19Å; S368-Q370 PolarHBondContact OG-N 2.82Å; S368-Q370 VanDerWaalsContact OG-N 3.15Å; Q370-V373 HydrophobicContact CB-CG1 3.72Å; Q370-V373 HydrophobicContact CG-CG1 4.01Å; Q370-V373 WeakPolarHBondContact O-CG1 3.41Å; Q370-V373 WeakPolarHBondContact O-CG2 3.31Å
371	K	85	Confident	92.6	Very high	204 Å²	204	50.5 Å²	50.5	89%	0.887	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	143.1	177.8	-65.4	-176.7	179.4	179.8	0	110.3	S369	S369-K371 PolarHBondContact O-N 2.85Å
372	G	80.5	Confident	92.6	Very high	90 Å²	90	50 Å²	50	93%	0.928	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	8.7	175.7	0	0	0	0	0	115.5
373	V	87.1	Confident	92.6	Very high	44 Å²	44	50 Å²	50	27%	0.267	29%	0.288	S	S	.	.			trans	-72	150	175	-63.1	0	0	0	0	112	T365 Q370 G375	T365-V373 HydrophobicContact CG2-CG2 4.44Å; Q370-V373 HydrophobicContact CB-CG1 3.72Å; Q370-V373 HydrophobicContact CG-CG1 4.01Å; Q370-V373 WeakPolarHBondContact O-CG1 3.41Å; Q370-V373 WeakPolarHBondContact O-CG2 3.31Å; V373-G375 PolarHBondContact O-N 2.94Å
374	K	85.9	Confident	92.5	Very high	163 Å²	163	48.9 Å²	48.9	71%	0.709	28%	0.282	S	S	*	.			trans	-66.6	-20.4	-179.5	-172.9	-179.8	172.1	-166.9	0	113.5	K403	K374-K403 PolarHBondContact O-NZ 3.04Å
375	G	89.9	Confident	92.4	Very high	22 Å²	22	49.1 Å²	49.1	23%	0.227	28%	0.283	C	S	.	.			trans	88.1	149.8	-169.7	0	0	0	0	0	112.5	S364 V373	S364-G375 CarbonylContact O-C 3.3Å; S364-G375 VanDerWaalsContact O-C 3.3Å; S364-G375 WeakPolarHBondContact O-CA 3.41Å; V373-G375 PolarHBondContact O-N 2.94Å
376	L	93.1	Very high	92	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.209	28%	0.276	C	S	.	.			trans	-71.6	144.8	175.3	-66.9	-174.5	0	0	0	110.6	F293 Y305 S364 F367 L378	F293-L376 HydrophobicContact CD1-CB 4.35Å; F293-L376 HydrophobicContact CD1-CD1 4.25Å; F293-L376 HydrophobicContact CE1-CB 4.32Å; F293-L376 HydrophobicContact CE1-CD1 3.82Å; Y305-L376 HydrophobicContact CD1-CD1 3.91Å; Y305-L376 HydrophobicContact CD2-CD1 3.82Å; Y305-L376 HydrophobicContact CE1-CD1 4.03Å; Y305-L376 HydrophobicContact CE2-CD1 3.96Å; Y305-L376 HydrophobicContact CG-CD1 3.83Å; S364-L376 PolarHBondContact O-N 3.4Å; F367-L376 HydrophobicContact CB-CD1 3.4Å; F367-L376 VanDerWaalsContact CB-CD1 3.4Å; F367-L376 HydrophobicContact CB-CG 4Å; F367-L376 HydrophobicContact CD2-CB 4.13Å; F367-L376 HydrophobicContact CD2-CD1 4.14Å; F367-L376 HydrophobicContact CD2-CG 4.38Å; F367-L376 HydrophobicContact CG-CD1 3.86Å; F367-L376 HydrophobicContact CG-CG 4.48Å; L376-L378 PolarHBondContact O-N 3.44Å
377	P	92.9	Very high	91.4	Very high	45 Å²	45	51.4 Å²	51.4	29%	0.292	29%	0.288	S	S	.	.			trans	-75.4	123.3	178.3	31.6	-33.2	0	0	0	110.4	S294 E295	S294-P377 PolarHBondContact N-O 2.87Å; E295-P377 HydrophobicContact CB-CG 4.33Å; E295-P377 HydrophobicContact CG-CG 3.57Å; E295-P377 VanDerWaalsContact OE1-CG 3.28Å; E295-P377 WeakPolarHBondContact OE1-CG 3.22Å
378	L	96.5	Very high	90.5	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	156.2	178.4	-65.1	175	0	0	0	109.8	V291 F293 W306 F367 L376 I402 V404	V291-L378 HydrophobicContact CG1-CD2 4.49Å; F293-L378 HydrophobicContact CD1-CD2 3.7Å; F293-L378 HydrophobicContact CE1-CD2 3.73Å; W306-L378 HydrophobicContact CH2-CD2 4.46Å; F367-L378 HydrophobicContact CE2-CD1 4.04Å; F367-L378 HydrophobicContact CE2-CD2 3.9Å; F367-L378 HydrophobicContact CE2-CG 4.3Å; F367-L378 HydrophobicContact CZ-CD1 4.5Å; F367-L378 HydrophobicContact CZ-CD2 4.06Å; L376-L378 PolarHBondContact O-N 3.44Å; L378-I402 HydrophobicContact CB-CD1 4.2Å; L378-I402 HydrophobicContact CB-CG1 3.79Å; L378-I402 PolarHBondContact O-N 2.82Å; L378-V404 HydrophobicContact CD1-CG2 4.33Å
379	M	96.5	Very high	89.7	Confident	15 Å²	15	58 Å²	58	7%	0.074	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	150.5	169.7	58.8	-174.7	-108.8	0	0	111	V291 V292 Q381 Y399 S400 I450	V291-M379 WeakPolarHBondContact CA-O 2.98Å; V292-M379 HydrophobicContact CG2-CE 4.03Å; V292-M379 HydrophobicContact CG2-CG 3.58Å; V292-M379 HydrophobicContact CG2-SD 4.36Å; V292-M379 PolarHBondContact N-O 3.42Å; V292-M379 PolarHBondContact O-N 2.78Å; M379-Q381 HydrophobicContact CE-CB 3.99Å; M379-Q381 HydrophobicContact CE-CG 4.26Å; M379-Y399 HydrophobicContact CB-CD2 4.4Å; M379-Y399 HydrophobicContact CE-CD2 4.01Å; M379-Y399 HydrophobicContact CE-CG 3.76Å; M379-Y399 HydrophobicContact SD-CD2 3.9Å; M379-Y399 HydrophobicContact SD-CG 4.28Å; M379-S400 CarbonylContact C-O 3.6Å; M379-S400 VanDerWaalsContact CA-O 3.24Å; M379-S400 WeakPolarHBondContact CA-O 3.45Å; M379-S400 WeakPolarHBondContact CB-O 3.36Å; M379-I450 HydrophobicContact CE-CD1 4.05Å
380	I	98	Very high	88.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.1	164.2	-58.9	175.9	0	0	0	106.4	L241 L259 I289 M290 I358 V360 Y399 S400 I402 F447	L241-I380 HydrophobicContact CD2-CD1 4.22Å; L259-I380 HydrophobicContact CD1-CD1 4.06Å; I289-I380 HydrophobicContact CD1-CG2 3.9Å; I289-I380 HydrophobicContact CG1-CG2 3.75Å; M290-I380 CarbonylContact O-C 3.56Å; M290-I380 VanDerWaalsContact O-CA 3.31Å; M290-I380 WeakPolarHBondContact O-CA 3.26Å; I358-I380 HydrophobicContact CD1-CD1 3.84Å; V360-I380 HydrophobicContact CG2-CD1 4.45Å; I380-Y399 CarbonylContact O-C 3.54Å; I380-Y399 WeakPolarHBondContact O-CA 3.43Å; I380-Y399 WeakPolarHBondContact O-CB 3.44Å; I380-S400 PolarHBondContact N-O 3.21Å; I380-S400 PolarHBondContact O-N 3.1Å; I380-I402 HydrophobicContact CD1-CD1 4.24Å; I380-I402 HydrophobicContact CD1-CG2 3.91Å; I380-I402 HydrophobicContact CG1-CD1 3.77Å; I380-I402 HydrophobicContact CG1-CG1 4.27Å; I380-I402 HydrophobicContact CG1-CG2 3.91Å; I380-F447 HydrophobicContact CB-CE1 4.07Å; I380-F447 HydrophobicContact CB-CZ 4.29Å; I380-F447 HydrophobicContact CG2-CE1 3.82Å; I380-F447 HydrophobicContact CG2-CZ 3.97Å
381	Q	97.6	Very high	88.4	Confident	17 Å²	17	61 Å²	61	8%	0.079	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	141.5	174	-172.3	-178.1	-53.5	0	0	109.3	M290 V292 M379 D383 R397 A398	M290-Q381 HydrophobicContact CE-CB 4.08Å; M290-Q381 HydrophobicContact CE-CG 3.81Å; M290-Q381 HydrophobicContact CG-CB 3.99Å; M290-Q381 VanDerWaalsContact CG-O 3.22Å; M290-Q381 WeakPolarHBondContact CG-O 3.2Å; M290-Q381 PolarHBondContact N-O 2.68Å; M290-Q381 PolarHBondContact O-N 3.34Å; M290-Q381 HydrophobicContact SD-CB 4.42Å; V292-Q381 HydrophobicContact CG2-CB 4.11Å; M379-Q381 HydrophobicContact CE-CB 3.99Å; M379-Q381 HydrophobicContact CE-CG 4.26Å; Q381-D383 PolarHBondContact NE2-OD1 2.78Å; Q381-R397 HydrophobicContact CG-CG 4.11Å; Q381-R397 VanDerWaalsContact NE2-NE 3.12Å; Q381-A398 WeakPolarHBondContact CA-O 3.31Å
382	I	98.2	Very high	88.2	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.3	175.6	-59.2	174.5	0	0	0	108.1	Y239 V267 L269 V288 I289 R397 A398 F447	Y239-I382 HydrophobicContact CD1-CG2 4.42Å; Y239-I382 HydrophobicContact CD2-CB 4.16Å; Y239-I382 HydrophobicContact CD2-CD1 4.24Å; Y239-I382 HydrophobicContact CD2-CG2 4.29Å; Y239-I382 HydrophobicContact CE1-CG2 4.22Å; Y239-I382 HydrophobicContact CE2-CB 4.17Å; Y239-I382 HydrophobicContact CE2-CG2 4.06Å; Y239-I382 HydrophobicContact CG-CD1 3.99Å; Y239-I382 HydrophobicContact CG-CG2 4.46Å; V267-I382 HydrophobicContact CG1-CD1 3.92Å; L269-I382 HydrophobicContact CD2-CG2 4.01Å; V288-I382 WeakPolarHBondContact O-CA 3.49Å; I289-I382 HydrophobicContact CB-CG1 4.31Å; I289-I382 HydrophobicContact CD1-CD1 4.13Å; I289-I382 HydrophobicContact CD1-CG1 4.13Å; I289-I382 HydrophobicContact CG1-CG1 4Å; I382-R397 WeakPolarHBondContact O-CA 3.49Å; I382-A398 PolarHBondContact N-O 3.21Å; I382-A398 PolarHBondContact O-N 3.06Å; I382-F447 HydrophobicContact CD1-CD1 4.09Å; I382-F447 HydrophobicContact CD1-CE1 3.65Å; I382-F447 HydrophobicContact CD1-CE2 4.27Å; I382-F447 HydrophobicContact CD1-CZ 3.75Å; I382-F447 HydrophobicContact CG1-CD1 4.36Å; I382-F447 HydrophobicContact CG1-CE1 3.9Å; I382-F447 HydrophobicContact CG1-CZ 4.41Å
383	D	97.2	Very high	88.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.9	173.1	-74.4	12.7	0	0	0	108.8	S287 V288 M290 Q381 Y385 P394 R397	S287-D383 CarbonylContact C-O 3.57Å; S287-D383 VanDerWaalsContact CA-O 3.27Å; S287-D383 WeakPolarHBondContact CA-O 3.18Å; V288-D383 PolarHBondContact N-O 3Å; V288-D383 PolarHBondContact O-N 3.3Å; M290-D383 HydrophobicContact CE-CB 3.95Å; M290-D383 VanDerWaalsContact CE-OD1 3.31Å; M290-D383 WeakPolarHBondContact CE-OD1 3.39Å; M290-D383 WeakPolarHBondContact CE-OD2 3.3Å; Q381-D383 PolarHBondContact NE2-OD1 2.78Å; D383-Y385 HydrophobicContact CB-CD2 4.46Å; D383-Y385 HydrophobicContact CB-CE2 3.54Å; D383-Y385 PolarHBondContact OD2-OH 3.4Å; D383-P394 HydrophobicContact CB-CB 4.12Å; D383-R397 VanDerWaalsContact CG-NE 3.32Å; D383-R397 WeakPolarHBondContact OD1-CD 3.39Å; D383-R397 WeakPolarHBondContact OD1-CG 3.43Å; D383-R397 IonicContact OD1-CZ 3.68Å; D383-R397 IonicContact OD1-NE 2.65Å; D383-R397 PolarHBondContact OD1-NE 2.91Å; D383-R397 IonicContact OD1-NH2 3.14Å; D383-R397 IonicContact OD2-CZ 2.83Å; D383-R397 IonicContact OD2-NE 2.77Å; D383-R397 PolarHBondContact OD2-NE 2.85Å; D383-R397 IonicContact OD2-NH2 2.74Å; D383-R397 PolarHBondContact OD2-NH2 3.35Å
384	T	96	Very high	88.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.1	178.1	-60.8	0	0	0	0	110.5	F237 Y239 V285 R286 S287 P394 L395 H396	F237-T384 HydrophobicContact CD1-CG2 4.36Å; F237-T384 HydrophobicContact CE1-CG2 4.03Å; F237-T384 HydrophobicContact CZ-CG2 4.14Å; Y239-T384 WeakPolarHBondContact OH-CB 3.29Å; Y239-T384 PolarHBondContact OH-OG1 3.23Å; V285-T384 HydrophobicContact CB-CG2 3.99Å; V285-T384 HydrophobicContact CG2-CG2 4.07Å; R286-T384 CarbonylContact O-C 3.58Å; R286-T384 WeakPolarHBondContact O-CA 3.19Å; S287-T384 PolarHBondContact OG-OG1 3.16Å; T384-P394 CarbonylContact O-C 3.54Å; T384-L395 WeakPolarHBondContact O-CA 3.24Å; T384-L395 WeakPolarHBondContact O-CB 3.2Å; T384-L395 PolarHBondContact O-N 2.75Å; T384-H396 PolarHBondContact N-O 2.84Å; T384-H396 PolarHBondContact O-N 3.46Å
385	Y	92.9	Very high	89.1	Confident	8 Å²	8	49.2 Å²	49.2	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	152.6	-175	-59	-95.9	0	0	0	110.3	V285 R286 V288 D383 N392 P394 F476	V285-Y385 WeakPolarHBondContact CB-O 3.47Å; R286-Y385 PolarHBondContact N-O 2.82Å; R286-Y385 PolarHBondContact O-N 2.9Å; V288-Y385 HydrophobicContact CB-CE2 4.47Å; V288-Y385 HydrophobicContact CG2-CD2 4.37Å; V288-Y385 HydrophobicContact CG2-CE2 3.94Å; D383-Y385 HydrophobicContact CB-CD2 4.46Å; D383-Y385 HydrophobicContact CB-CE2 3.54Å; D383-Y385 PolarHBondContact OD2-OH 3.4Å; Y385-N392 WeakPolarHBondContact CE1-O 3.28Å; Y385-P394 HydrophobicContact CD1-CB 4.13Å; Y385-P394 HydrophobicContact CE1-CB 3.76Å; Y385-P394 HydrophobicContact CE1-CG 4.3Å; Y385-P394 HydrophobicContact CE2-CB 4.34Å; Y385-F476 HydrophobicContact CE1-CZ 4.11Å; Y385-F476 AromaticContact CZ-CZ 3.87Å; Y385-F476 WeakPolarHBondContact OH-CZ 3.18Å
386	S	88.7	Confident	89.3	Confident	36 Å²	36	48.7 Å²	48.7	25%	0.252	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	138.1	166.7	179.4	0	0	0	0	109.5
387	Y	83.4	Confident	89.5	Confident	111 Å²	111	47.1 Å²	47.1	44%	0.435	23%	0.228	S	C	.	.	S	Bend	trans	-70.2	-36.7	179.2	-173.4	-108.7	0	0	0	112.9	K284 T347	K284-Y387 HydrophobicContact CB-CD1 4.4Å; K284-Y387 HydrophobicContact CB-CG 4.27Å; K284-Y387 WeakPolarHBondContact O-CB 3.41Å; T347-Y387 HydrophobicContact CG2-CD2 3.79Å; T347-Y387 HydrophobicContact CG2-CE2 3.67Å
388	N	76	Confident	89.6	Confident	100 Å²	100	45 Å²	45	54%	0.535	22%	0.215	S	C	.	.	S	Bend	trans	-92.8	-11.8	-174.1	-69.2	-2.8	0	0	0	113.8	I282	I282-N388 VanDerWaalsContact CD1-ND2 3.28Å; I282-N388 WeakPolarHBondContact CD1-ND2 3.21Å; I282-N388 WeakPolarHBondContact CG1-ND2 3.47Å
389	N	71.9	Confident	89.6	Confident	95 Å²	95	46.6 Å²	46.6	51%	0.508	22%	0.221	S	C	.	.			trans	-93.9	125.9	-179.4	-166.3	-7.9	0	0	0	109.7	S391	N389-S391 PolarHBondContact O-N 2.75Å; N389-S391 VanDerWaalsContact O-N 3.08Å; N389-S391 PolarHBondContact OD1-N 2.81Å
390	R	69.9	Low	89.6	Confident	243 Å²	243	45.9 Å²	45.9	92%	0.917	22%	0.217	S	C	*	.			trans	-77	19.4	173.6	-62.5	-172	-179.3	-160.9	0.2	113.1
391	S	78.9	Confident	89.5	Confident	46 Å²	46	46.7 Å²	46.7	32%	0.322	22%	0.221	S	C	.	.			trans	-69.4	131.6	176.3	172.3	0	0	0	0	110.6	N389 K393	N389-S391 PolarHBondContact O-N 2.75Å; N389-S391 VanDerWaalsContact O-N 3.08Å; N389-S391 PolarHBondContact OD1-N 2.81Å; S391-K393 PolarHBondContact O-N 2.74Å; S391-K393 WeakPolarHBondContact OG-CB 3.42Å; S391-K393 PolarHBondContact OG-N 2.8Å; S391-K393 PolarHBondContact OG-O 2.82Å
392	N	80.4	Confident	89.4	Confident	62 Å²	62	46 Å²	46	33%	0.332	22%	0.218	S	C	.	.	S	Bend	trans	-78.6	-6.1	172	-62.1	-14.2	0	0	0	112.4	Y385 V475 F476	Y385-N392 WeakPolarHBondContact CE1-O 3.28Å; N392-V475 VanDerWaalsContact CG-O 3.31Å; N392-V475 PolarHBondContact ND2-O 3.38Å; N392-V475 VanDerWaalsContact ND2-O 3.17Å; N392-V475 WeakPolarHBondContact OD1-CG1 3.31Å; N392-F476 HydrophobicContact CB-CE1 4.44Å
393	K	88.6	Confident	89.3	Confident	94 Å²	94	48.4 Å²	48.4	41%	0.409	23%	0.228	S	C	.	.	S	Bend	trans	-89.3	126.9	177.3	-174.8	176.7	-179.8	164	0	111	S391 L453 E454	S391-K393 PolarHBondContact O-N 2.74Å; S391-K393 WeakPolarHBondContact OG-CB 3.42Å; S391-K393 PolarHBondContact OG-N 2.8Å; S391-K393 PolarHBondContact OG-O 2.82Å; K393-L453 HydrophobicContact CG-CB 4.12Å; K393-E454 VanDerWaalsContact CD-OE1 3.3Å; K393-E454 WeakPolarHBondContact CD-OE1 3.49Å; K393-E454 WeakPolarHBondContact CE-OE1 3.5Å; K393-E454 IonicContact NZ-OE1 3.95Å; K393-E454 PolarHBondContact NZ-OE1 2.9Å
394	P	92.8	Very high	89.3	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.032	23%	0.229	C	C	.	.			trans	-66.4	148.6	174.2	26.8	-31.7	0	0	0	111.4	D383 T384 Y385 L453	D383-P394 HydrophobicContact CB-CB 4.12Å; T384-P394 CarbonylContact O-C 3.54Å; Y385-P394 HydrophobicContact CD1-CB 4.13Å; Y385-P394 HydrophobicContact CE1-CB 3.76Å; Y385-P394 HydrophobicContact CE1-CG 4.3Å; Y385-P394 HydrophobicContact CE2-CB 4.34Å; P394-L453 WeakPolarHBondContact CD-O 3.48Å; P394-L453 HydrophobicContact CG-CB 4.23Å; P394-L453 HydrophobicContact CG-CD2 4.14Å
395	L	92.1	Very high	89.3	Confident	92 Å²	92	50.5 Å²	50.5	48%	0.482	24%	0.238	S	C	.	.	S	Bend	trans	-71.9	-36.1	169.9	-60.9	178.4	0	0	0	111.5	T384	T384-L395 WeakPolarHBondContact O-CA 3.24Å; T384-L395 WeakPolarHBondContact O-CB 3.2Å; T384-L395 PolarHBondContact O-N 2.75Å
396	H	94.5	Very high	89.4	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.051	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	144.4	-179.3	-176.6	-103.1	0	0	0	110.1	F237 Y239 T384 T449	F237-H396 HydrophobicContact CB-CB 4.3Å; F237-H396 HydrophobicContact CD2-CB 3.7Å; F237-H396 HydrophobicContact CE2-CB 4.47Å; F237-H396 HydrophobicContact CG-CB 4.29Å; Y239-H396 AromaticContact CE2-CE1 3.54Å; Y239-H396 AromaticContact CE2-ND1 3.29Å; Y239-H396 VanDerWaalsContact CE2-ND1 3.29Å; Y239-H396 WeakPolarHBondContact CE2-ND1 3.47Å; Y239-H396 AromaticContact CZ-CE1 3.98Å; Y239-H396 AromaticContact CZ-ND1 3.38Å; Y239-H396 PolarHBondContact OH-ND1 3.11Å; T384-H396 PolarHBondContact N-O 2.84Å; T384-H396 PolarHBondContact O-N 3.46Å; H396-T449 WeakPolarHBondContact NE2-CG2 3.39Å; H396-T449 PolarHBondContact NE2-OG1 2.92Å; H396-T449 VanDerWaalsContact NE2-OG1 3.11Å
397	R	96.1	Very high	89.7	Confident	8 Å²	8	57 Å²	57	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137.9	177.3	177.6	173.7	-71.6	167.7	-11.7	109.6	Q381 I382 D383 T449 I450 D452 L453 A455	Q381-R397 HydrophobicContact CG-CG 4.11Å; Q381-R397 VanDerWaalsContact NE2-NE 3.12Å; I382-R397 WeakPolarHBondContact O-CA 3.49Å; D383-R397 VanDerWaalsContact CG-NE 3.32Å; D383-R397 WeakPolarHBondContact OD1-CD 3.39Å; D383-R397 WeakPolarHBondContact OD1-CG 3.43Å; D383-R397 IonicContact OD1-CZ 3.68Å; D383-R397 IonicContact OD1-NE 2.65Å; D383-R397 PolarHBondContact OD1-NE 2.91Å; D383-R397 IonicContact OD1-NH2 3.14Å; D383-R397 IonicContact OD2-CZ 2.83Å; D383-R397 IonicContact OD2-NE 2.77Å; D383-R397 PolarHBondContact OD2-NE 2.85Å; D383-R397 IonicContact OD2-NH2 2.74Å; D383-R397 PolarHBondContact OD2-NH2 3.35Å; R397-T449 WeakPolarHBondContact O-CA 3.31Å; R397-I450 HydrophobicContact CB-CB 4.24Å; R397-I450 HydrophobicContact CG-CB 3.79Å; R397-I450 HydrophobicContact CG-CD1 3.91Å; R397-I450 HydrophobicContact CG-CG1 4.08Å; R397-I450 HydrophobicContact CG-CG2 4.47Å; R397-I450 PolarHBondContact O-N 3.19Å; R397-D452 WeakPolarHBondContact CD-O 3.37Å; R397-D452 PolarHBondContact NH1-O 3.32Å; R397-L453 HydrophobicContact CB-CD2 3.62Å; R397-A455 PolarHBondContact NH1-O 2.63Å; R397-A455 PolarHBondContact NH2-O 2.92Å
398	A	96.3	Very high	90.2	Very high	1 Å²	1	57 Å²	57	1%	0.008	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	163.4	173.2	0	0	0	0	0	112	Y239 Q381 I382 F447 K448	Y239-A398 HydrophobicContact CD2-CB 3.61Å; Y239-A398 HydrophobicContact CE2-CB 3.62Å; Q381-A398 WeakPolarHBondContact CA-O 3.31Å; I382-A398 PolarHBondContact N-O 3.21Å; I382-A398 PolarHBondContact O-N 3.06Å; A398-F447 HydrophobicContact CB-CB 3.83Å; A398-K448 CarbonylContact C-O 3.56Å; A398-K448 WeakPolarHBondContact CA-O 3.4Å; A398-K448 WeakPolarHBondContact CB-O 3.39Å
399	Y	96.2	Very high	91.2	Very high	33 Å²	33	52.4 Å²	52.4	13%	0.129	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.7	-179.3	76	-72.7	0	0	0	114.7	M379 I380 Q401 F447 K448 I450	M379-Y399 HydrophobicContact CB-CD2 4.4Å; M379-Y399 HydrophobicContact CE-CD2 4.01Å; M379-Y399 HydrophobicContact CE-CG 3.76Å; M379-Y399 HydrophobicContact SD-CD2 3.9Å; M379-Y399 HydrophobicContact SD-CG 4.28Å; I380-Y399 CarbonylContact O-C 3.54Å; I380-Y399 WeakPolarHBondContact O-CA 3.43Å; I380-Y399 WeakPolarHBondContact O-CB 3.44Å; Y399-Q401 HydrophobicContact CD2-CG 4.27Å; Y399-Q401 HydrophobicContact CE2-CG 3.96Å; Y399-F447 CarbonylContact O-C 3.19Å; Y399-F447 WeakPolarHBondContact O-CA 3.26Å; Y399-K448 HydrophobicContact CD1-CB 4.27Å; Y399-K448 VanDerWaalsContact CD1-O 3.23Å; Y399-K448 WeakPolarHBondContact CD1-O 3.44Å; Y399-K448 HydrophobicContact CE1-CB 3.94Å; Y399-K448 HydrophobicContact CE1-CD 4.06Å; Y399-K448 HydrophobicContact CE1-CG 4.07Å; Y399-K448 PolarHBondContact N-O 3.44Å; Y399-K448 PolarHBondContact O-N 3.13Å; Y399-I450 HydrophobicContact CD1-CD1 3.54Å; Y399-I450 HydrophobicContact CD1-CG1 3.35Å; Y399-I450 HydrophobicContact CE1-CD1 4.29Å; Y399-I450 HydrophobicContact CE1-CG1 3.88Å; Y399-I450 HydrophobicContact CG-CD1 4.04Å; Y399-I450 HydrophobicContact CG-CG1 4.3Å
400	S	95.4	Very high	92.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.5	164.6	174.9	0	0	0	0	109	P255 M379 I380	P255-S400 PolarHBondContact O-OG 2.98Å; M379-S400 CarbonylContact C-O 3.6Å; M379-S400 VanDerWaalsContact CA-O 3.24Å; M379-S400 WeakPolarHBondContact CA-O 3.45Å; M379-S400 WeakPolarHBondContact CB-O 3.36Å; I380-S400 PolarHBondContact N-O 3.21Å; I380-S400 PolarHBondContact O-N 3.1Å
401	Q	95.6	Very high	93.4	Very high	17 Å²	17	39.4 Å²	39.4	8%	0.079	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.6	174.4	-66.4	-176	-15.1	0	0	109.3	P255 M256 T257 Y399	P255-Q401 WeakPolarHBondContact O-CB 3.43Å; P255-Q401 PolarHBondContact O-N 3.29Å; M256-Q401 CarbonylContact C-O 3.53Å; M256-Q401 WeakPolarHBondContact CA-O 3.41Å; M256-Q401 HydrophobicContact CE-CB 3.74Å; M256-Q401 HydrophobicContact SD-CB 4.22Å; T257-Q401 PolarHBondContact N-O 2.78Å; Y399-Q401 HydrophobicContact CD2-CG 4.27Å; Y399-Q401 HydrophobicContact CE2-CG 3.96Å
402	I	96.2	Very high	94.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.8	-178.7	58.9	160	0	0	0	111.8	L241 T257 L259 V291 V360 L378 I380 V404	L241-I402 HydrophobicContact CD2-CG2 4.47Å; T257-I402 CarbonylContact O-C 3.53Å; T257-I402 VanDerWaalsContact O-CA 3.31Å; T257-I402 WeakPolarHBondContact O-CA 3.47Å; L259-I402 HydrophobicContact CD1-CB 4.18Å; L259-I402 HydrophobicContact CD1-CD1 4.16Å; L259-I402 HydrophobicContact CD1-CG2 3.86Å; L259-I402 HydrophobicContact CG-CG2 4.35Å; V291-I402 HydrophobicContact CG1-CD1 4.43Å; V360-I402 HydrophobicContact CG1-CD1 4.33Å; V360-I402 HydrophobicContact CG2-CD1 4.17Å; L378-I402 HydrophobicContact CB-CD1 4.2Å; L378-I402 HydrophobicContact CB-CG1 3.79Å; L378-I402 PolarHBondContact O-N 2.82Å; I380-I402 HydrophobicContact CD1-CD1 4.24Å; I380-I402 HydrophobicContact CD1-CG2 3.91Å; I380-I402 HydrophobicContact CG1-CD1 3.77Å; I380-I402 HydrophobicContact CG1-CG1 4.27Å; I380-I402 HydrophobicContact CG1-CG2 3.91Å; I402-V404 HydrophobicContact CD1-CG2 3.88Å
403	K	95.7	Very high	94.8	Very high	53 Å²	53	42.3 Å²	42.3	23%	0.23	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.8	164.3	-167.5	165.9	-176.3	150.8	0	109.2	M256 T257 Y258 L259 K374 F405	M256-K403 HydrophobicContact SD-CB 4.08Å; T257-K403 PolarHBondContact O-N 3.15Å; Y258-K403 WeakPolarHBondContact CA-O 3.37Å; Y258-K403 HydrophobicContact CD1-CB 3.83Å; Y258-K403 HydrophobicContact CE1-CB 4.1Å; L259-K403 PolarHBondContact N-O 3.35Å; K374-K403 PolarHBondContact O-NZ 3.04Å; K403-F405 HydrophobicContact CB-CE2 3.93Å; K403-F405 HydrophobicContact CB-CZ 4.25Å; K403-F405 HydrophobicContact CD-CE1 4.33Å; K403-F405 HydrophobicContact CD-CE2 4.22Å; K403-F405 HydrophobicContact CD-CZ 3.66Å; K403-F405 HydrophobicContact CG-CE1 4.4Å; K403-F405 HydrophobicContact CG-CE2 3.78Å; K403-F405 HydrophobicContact CG-CZ 3.7Å; K403-F405 WeakPolarHBondContact O-CD2 3.23Å; K403-F405 WeakPolarHBondContact O-CE2 3.48Å
404	V	97.1	Very high	95	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.024	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.9	-173.9	-169.5	0	0	0	0	109.5	L259 K261 V360 C362 L363 S364 L378 I402	L259-V404 HydrophobicContact CB-CG2 4.48Å; L259-V404 CarbonylContact O-C 3.53Å; L259-V404 WeakPolarHBondContact O-CA 3.48Å; K261-V404 HydrophobicContact CB-CG1 4.12Å; V360-V404 HydrophobicContact CB-CG2 4.22Å; V360-V404 HydrophobicContact CG1-CG2 3.81Å; C362-V404 WeakPolarHBondContact O-CB 3.34Å; C362-V404 VanDerWaalsContact O-CG1 3.26Å; C362-V404 WeakPolarHBondContact O-CG1 3.48Å; L363-V404 HydrophobicContact CD2-CG1 4.41Å; S364-V404 PolarHBondContact N-O 2.92Å; S364-V404 PolarHBondContact OG-N 2.84Å; S364-V404 VanDerWaalsContact OG-N 3.1Å; L378-V404 HydrophobicContact CD1-CG2 4.33Å; I402-V404 HydrophobicContact CD1-CG2 3.88Å
405	F	96.4	Very high	94.9	Very high	40 Å²	40	44.8 Å²	44.8	18%	0.175	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	158	-178.3	-61.1	-90.5	0	0	0	110.9	Y258 L259 N260 K261 L363 K403 A410 K413	Y258-F405 AromaticContact CD1-CE2 3.78Å; Y258-F405 HydrophobicContact CD1-CE2 3.78Å; Y258-F405 HydrophobicContact CD1-CZ 4.35Å; Y258-F405 HydrophobicContact CE1-CE2 4.45Å; Y258-F405 AromaticContact CG-CE2 3.88Å; Y258-F405 HydrophobicContact CG-CE2 3.88Å; L259-F405 PolarHBondContact O-N 3.49Å; N260-F405 CarbonylContact C-O 3.54Å; N260-F405 WeakPolarHBondContact CA-O 3.45Å; K261-F405 PolarHBondContact N-O 3Å; L363-F405 VanDerWaalsContact CD2-C 3.42Å; K403-F405 HydrophobicContact CB-CE2 3.93Å; K403-F405 HydrophobicContact CB-CZ 4.25Å; K403-F405 HydrophobicContact CD-CE1 4.33Å; K403-F405 HydrophobicContact CD-CE2 4.22Å; K403-F405 HydrophobicContact CD-CZ 3.66Å; K403-F405 HydrophobicContact CG-CE1 4.4Å; K403-F405 HydrophobicContact CG-CE2 3.78Å; K403-F405 HydrophobicContact CG-CZ 3.7Å; K403-F405 WeakPolarHBondContact O-CD2 3.23Å; K403-F405 WeakPolarHBondContact O-CE2 3.48Å; F405-A410 HydrophobicContact CD2-CB 4.1Å; F405-K413 HydrophobicContact CE1-CB 4.31Å; F405-K413 HydrophobicContact CE1-CG 4.42Å; F405-K413 HydrophobicContact CE2-CB 4.38Å; F405-K413 HydrophobicContact CE2-CG 4.44Å; F405-K413 HydrophobicContact CZ-CB 3.95Å; F405-K413 HydrophobicContact CZ-CD 4.37Å; F405-K413 HydrophobicContact CZ-CG 3.81Å
406	C	95.6	Very high	94.9	Very high	58 Å²	58	43.3 Å²	43.3	39%	0.392	20%	0.201	S	C	.	.	S	Bend	trans	-84.2	157.1	166.6	56.3	0	0	0	0	111	L363 G409	L363-C406 HydrophobicContact CD1-CB 4.17Å; L363-C406 HydrophobicContact CD2-CB 4.03Å; C406-G409 WeakPolarHBondContact O-CA 3.07Å; C406-G409 PolarHBondContact O-N 3.44Å
407	D	94.3	Very high	94.8	Very high	122 Å²	122	43 Å²	43	65%	0.652	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	-135.9	179.3	-46.6	-42.8	0	0	0	111.3	N260 G409	N260-D407 VanDerWaalsContact CB-O 3.3Å; N260-D407 WeakPolarHBondContact CB-O 3.28Å; N260-D407 PolarHBondContact OD1-O 2.79Å; D407-G409 PolarHBondContact O-N 2.88Å
408	K	94.9	Very high	94.5	Very high	111 Å²	111	47.3 Å²	47.3	48%	0.483	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	39.2	173.2	-63.4	-65.3	-175.6	-176.5	0	113.2	E411 R412	K408-E411 VanDerWaalsContact CA-OE2 3.24Å; K408-E411 WeakPolarHBondContact CA-OE2 3.26Å; K408-E411 WeakPolarHBondContact CD-OE1 3.49Å; K408-E411 IonicContact NZ-OE1 2.77Å; K408-E411 PolarHBondContact NZ-OE1 3.42Å; K408-E411 VanDerWaalsContact NZ-OE1 3.11Å; K408-R412 WeakPolarHBondContact O-CG 3.27Å; K408-R412 PolarHBondContact O-N 2.81Å
409	G	95.8	Very high	94.2	Very high	4 Å²	4	53.9 Å²	53.9	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-73.1	-32.7	-173	0	0	0	0	0	113.7	N260 C406 D407 R412 K413	N260-G409 PolarHBondContact OD1-N 2.88Å; C406-G409 WeakPolarHBondContact O-CA 3.07Å; C406-G409 PolarHBondContact O-N 3.44Å; D407-G409 PolarHBondContact O-N 2.88Å; G409-R412 PolarHBondContact O-N 2.93Å; G409-K413 WeakPolarHBondContact O-CB 3.45Å; G409-K413 PolarHBondContact O-N 2.87Å
410	A	94.9	Very high	93.9	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-49.1	173.2	0	0	0	0	0	111	N260 F405 R412 K413 I414	N260-A410 VanDerWaalsContact OD1-CB 3.22Å; N260-A410 WeakPolarHBondContact OD1-CB 3.4Å; N260-A410 PolarHBondContact OD1-N 2.93Å; F405-A410 HydrophobicContact CD2-CB 4.1Å; A410-R412 PolarHBondContact O-N 3.37Å; A410-K413 WeakPolarHBondContact O-CB 3.11Å; A410-K413 PolarHBondContact O-N 2.89Å; A410-K413 VanDerWaalsContact O-N 3.08Å; A410-I414 WeakPolarHBondContact O-CD1 3.21Å; A410-I414 WeakPolarHBondContact O-CG1 3.31Å; A410-I414 PolarHBondContact O-N 2.86Å
411	E	94.1	Very high	93.5	Very high	60 Å²	60	61.8 Å²	61.8	28%	0.28	28%	0.283	S	S	.	.	H	α-helix	trans	-65.5	-37.9	179.9	-60.2	91.1	151.3	0	0	111.9	N260 K408 K413 I414 R415	N260-E411 VanDerWaalsContact ND2-CD 3.31Å; N260-E411 PolarHBondContact ND2-OE1 2.91Å; N260-E411 PolarHBondContact ND2-OE2 2.94Å; K408-E411 VanDerWaalsContact CA-OE2 3.24Å; K408-E411 WeakPolarHBondContact CA-OE2 3.26Å; K408-E411 WeakPolarHBondContact CD-OE1 3.49Å; K408-E411 IonicContact NZ-OE1 2.77Å; K408-E411 PolarHBondContact NZ-OE1 3.42Å; K408-E411 VanDerWaalsContact NZ-OE1 3.11Å; E411-K413 VanDerWaalsContact C-N 3.32Å; E411-I414 PolarHBondContact O-N 2.99Å; E411-R415 WeakPolarHBondContact O-CG 3.48Å; E411-R415 PolarHBondContact O-N 2.83Å; E411-R415 VanDerWaalsContact O-N 3.13Å
412	R	94.4	Very high	93	Very high	109 Å²	109	67 Å²	67	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-43.4	171.3	-73.1	-169.6	-56.8	-93.8	4.8	111.3	K408 G409 A410 I414 R415 D416	K408-R412 WeakPolarHBondContact O-CG 3.27Å; K408-R412 PolarHBondContact O-N 2.81Å; G409-R412 PolarHBondContact O-N 2.93Å; A410-R412 PolarHBondContact O-N 3.37Å; R412-I414 PolarHBondContact O-N 2.82Å; R412-R415 PolarHBondContact O-N 2.71Å; R412-D416 PolarHBondContact O-N 2.77Å
413	K	93.9	Very high	92.6	Very high	61 Å²	61	76 Å²	76	27%	0.265	34%	0.344	S	S	.	.	H	α-helix	trans	-63.8	-40.5	-179.3	-177.9	62.6	179.8	176.8	0	112.4	Y258 F405 G409 A410 E411 D416 E417	Y258-K413 HydrophobicContact CD2-CB 4.28Å; Y258-K413 HydrophobicContact CD2-CG 3.88Å; Y258-K413 HydrophobicContact CE1-CG 4.49Å; Y258-K413 HydrophobicContact CE2-CB 4.33Å; Y258-K413 HydrophobicContact CE2-CG 3.49Å; Y258-K413 VanDerWaalsContact CE2-CG 3.49Å; F405-K413 HydrophobicContact CE1-CB 4.31Å; F405-K413 HydrophobicContact CE1-CG 4.42Å; F405-K413 HydrophobicContact CE2-CB 4.38Å; F405-K413 HydrophobicContact CE2-CG 4.44Å; F405-K413 HydrophobicContact CZ-CB 3.95Å; F405-K413 HydrophobicContact CZ-CD 4.37Å; F405-K413 HydrophobicContact CZ-CG 3.81Å; G409-K413 WeakPolarHBondContact O-CB 3.45Å; G409-K413 PolarHBondContact O-N 2.87Å; A410-K413 WeakPolarHBondContact O-CB 3.11Å; A410-K413 PolarHBondContact O-N 2.89Å; A410-K413 VanDerWaalsContact O-N 3.08Å; E411-K413 VanDerWaalsContact C-N 3.32Å; K413-D416 WeakPolarHBondContact O-CB 3.38Å; K413-D416 PolarHBondContact O-N 3.13Å; K413-E417 WeakPolarHBondContact CE-OE1 3.23Å; K413-E417 WeakPolarHBondContact O-CG 3.19Å; K413-E417 PolarHBondContact O-N 2.81Å; K413-E417 VanDerWaalsContact O-N 3.09Å
414	I	92	Very high	91.8	Very high	14 Å²	14	81 Å²	81	7%	0.072	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-49.6	177.8	-66.1	152.3	0	0	0	110.1	T244 Y258 A410 E411 R412 D416 E417 E418	T244-I414 VanDerWaalsContact CB-CD1 3.43Å; T244-I414 HydrophobicContact CG2-CD1 3.35Å; T244-I414 HydrophobicContact CG2-CG1 4.05Å; T244-I414 HydrophobicContact CG2-CG2 4.23Å; Y258-I414 HydrophobicContact CD2-CD1 4.36Å; Y258-I414 HydrophobicContact CD2-CG1 3.76Å; Y258-I414 HydrophobicContact CE2-CG1 4.38Å; A410-I414 WeakPolarHBondContact O-CD1 3.21Å; A410-I414 WeakPolarHBondContact O-CG1 3.31Å; A410-I414 PolarHBondContact O-N 2.86Å; E411-I414 PolarHBondContact O-N 2.99Å; R412-I414 PolarHBondContact O-N 2.82Å; I414-D416 VanDerWaalsContact C-N 3.26Å; I414-D416 PolarHBondContact O-N 2.96Å; I414-E417 WeakPolarHBondContact O-CA 3.36Å; I414-E417 WeakPolarHBondContact O-CB 3.39Å; I414-E417 PolarHBondContact O-N 2.88Å; I414-E418 HydrophobicContact CG2-CG 4.39Å; I414-E418 WeakPolarHBondContact O-CG 3.32Å; I414-E418 PolarHBondContact O-N 3.05Å
415	R	92	Very high	90.4	Very high	137 Å²	137	87.7 Å²	87.7	52%	0.517	40%	0.395	S	S	.	.	H	α-helix	trans	-59.1	-35.9	176.7	-71.2	-172.9	-66.9	162.5	-5.1	113	E411 R412 R419	E411-R415 WeakPolarHBondContact O-CG 3.48Å; E411-R415 PolarHBondContact O-N 2.83Å; E411-R415 VanDerWaalsContact O-N 3.13Å; R412-R415 PolarHBondContact O-N 2.71Å; R415-R419 WeakPolarHBondContact O-CB 3.35Å; R415-R419 WeakPolarHBondContact O-CG 3.22Å; R415-R419 PolarHBondContact O-N 2.76Å; R415-R419 PolarHBondContact O-NE 3.43Å
416	D	91.7	Very high	88.7	Confident	61 Å²	61	90.4 Å²	90.4	33%	0.326	42%	0.419	S	S	.	.	H	α-helix	trans	-64.4	-39.8	172.8	-79.7	-24.1	0	0	0	112.1	R412 K413 I414 R419 K420	R412-D416 PolarHBondContact O-N 2.77Å; K413-D416 WeakPolarHBondContact O-CB 3.38Å; K413-D416 PolarHBondContact O-N 3.13Å; I414-D416 VanDerWaalsContact C-N 3.26Å; I414-D416 PolarHBondContact O-N 2.96Å; D416-R419 IonicContact OD1-CZ 3.33Å; D416-R419 VanDerWaalsContact OD1-CZ 3.22Å; D416-R419 IonicContact OD1-NH1 3.22Å; D416-R419 PolarHBondContact OD1-NH1 3.21Å; D416-R419 IonicContact OD1-NH2 2.77Å; D416-R419 PolarHBondContact OD1-NH2 2.9Å; D416-K420 WeakPolarHBondContact O-CB 3.27Å; D416-K420 VanDerWaalsContact O-CG 3.28Å; D416-K420 WeakPolarHBondContact O-CG 3.34Å; D416-K420 PolarHBondContact O-N 3.49Å; D416-K420 VanDerWaalsContact O-N 3.12Å
417	E	91.8	Very high	87	Confident	4 Å²	4	96.9 Å²	96.9	2%	0.019	44%	0.44	C	S	.	.	H	α-helix	trans	-69.4	-42.4	177.7	-73.8	-174.7	-179.5	0	0	112.1	L247 R248 Y258 K413 I414 K420 L421	L247-E417 HydrophobicContact CD1-CB 4.34Å; L247-E417 PolarHBondContact N-OE2 3.42Å; R248-E417 IonicContact NE-OE1 3.7Å; Y258-E417 PolarHBondContact OH-OE1 2.77Å; K413-E417 WeakPolarHBondContact CE-OE1 3.23Å; K413-E417 WeakPolarHBondContact O-CG 3.19Å; K413-E417 PolarHBondContact O-N 2.81Å; K413-E417 VanDerWaalsContact O-N 3.09Å; I414-E417 WeakPolarHBondContact O-CA 3.36Å; I414-E417 WeakPolarHBondContact O-CB 3.39Å; I414-E417 PolarHBondContact O-N 2.88Å; E417-K420 PolarHBondContact O-N 3.39Å; E417-L421 PolarHBondContact O-N 3.08Å
418	E	90.1	Very high	84.9	Confident	99 Å²	99	94 Å²	94	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-58.3	-49.6	173.8	-70.5	174.5	158.4	0	0	111.5	L247 I414 K420 L421 L422	L247-E418 HydrophobicContact CD1-CB 4.42Å; L247-E418 HydrophobicContact CD1-CG 3.44Å; L247-E418 VanDerWaalsContact CD1-CG 3.44Å; I414-E418 HydrophobicContact CG2-CG 4.39Å; I414-E418 WeakPolarHBondContact O-CG 3.32Å; I414-E418 PolarHBondContact O-N 3.05Å; E418-K420 VanDerWaalsContact C-N 3.27Å; E418-K420 PolarHBondContact O-N 2.88Å; E418-L421 PolarHBondContact O-N 2.88Å; E418-L421 VanDerWaalsContact O-N 3.12Å; E418-L422 PolarHBondContact O-N 3.36Å
419	R	90.8	Very high	83	Confident	138 Å²	138	98 Å²	98	52%	0.521	46%	0.457	S	S	.	.	H	α-helix	trans	-58.3	-39.1	175.6	-80.1	-177.1	-82.1	134.9	-3.6	112.2	R415 D416 R423	R415-R419 WeakPolarHBondContact O-CB 3.35Å; R415-R419 WeakPolarHBondContact O-CG 3.22Å; R415-R419 PolarHBondContact O-N 2.76Å; R415-R419 PolarHBondContact O-NE 3.43Å; D416-R419 IonicContact OD1-CZ 3.33Å; D416-R419 VanDerWaalsContact OD1-CZ 3.22Å; D416-R419 IonicContact OD1-NH1 3.22Å; D416-R419 PolarHBondContact OD1-NH1 3.21Å; D416-R419 IonicContact OD1-NH2 2.77Å; D416-R419 PolarHBondContact OD1-NH2 2.9Å; R419-R423 WeakPolarHBondContact O-CG 3.33Å; R419-R423 PolarHBondContact O-N 3.47Å
420	K	90.1	Very high	80.5	Confident	112 Å²	112	105.1 Å²	105.1	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-69.6	-35.4	176.9	-76.6	174.9	-177.8	178.8	0	112.7	D416 E417 E418 K424	D416-K420 WeakPolarHBondContact O-CB 3.27Å; D416-K420 VanDerWaalsContact O-CG 3.28Å; D416-K420 WeakPolarHBondContact O-CG 3.34Å; D416-K420 PolarHBondContact O-N 3.49Å; D416-K420 VanDerWaalsContact O-N 3.12Å; E417-K420 PolarHBondContact O-N 3.39Å; E418-K420 VanDerWaalsContact C-N 3.27Å; E418-K420 PolarHBondContact O-N 2.88Å; K420-K424 PolarHBondContact O-N 3.41Å
421	L	85.9	Confident	78	Confident	87 Å²	87	109.6 Å²	109.6	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-68.3	-43.9	175.4	-86.1	151.2	0	0	0	111.3	L247 E417 E418 R423 K424 K425	L247-L421 HydrophobicContact CB-CD1 3.61Å; L247-L421 HydrophobicContact CD1-CD1 3.65Å; L247-L421 HydrophobicContact CG-CD1 4.2Å; E417-L421 PolarHBondContact O-N 3.08Å; E418-L421 PolarHBondContact O-N 2.88Å; E418-L421 VanDerWaalsContact O-N 3.12Å; L421-R423 PolarHBondContact O-N 3.25Å; L421-K424 WeakPolarHBondContact O-CB 3.49Å; L421-K424 PolarHBondContact O-N 3.35Å; L421-K424 VanDerWaalsContact O-N 3.1Å; L421-K425 PolarHBondContact O-N 3.15Å; L421-K425 VanDerWaalsContact O-N 3.13Å
422	L	84.8	Confident	75.3	Confident	126 Å²	126	112.5 Å²	112.5	66%	0.66	56%	0.558	S	S	*	*	H	α-helix	trans	-62.8	-41.9	179.5	-143.7	71.7	0	0	0	111.9	E418 K424 K425 S426	E418-L422 PolarHBondContact O-N 3.36Å; L422-K424 VanDerWaalsContact C-N 3.27Å; L422-K424 PolarHBondContact O-N 3.06Å; L422-K425 PolarHBondContact O-N 2.77Å; L422-S426 PolarHBondContact O-N 2.99Å; L422-S426 PolarHBondContact O-OG 2.84Å
423	R	87.6	Confident	73	Confident	192 Å²	192	114.5 Å²	114.5	73%	0.725	58%	0.582	S	S	*	*	H	α-helix	trans	-63.1	-27.7	174	-74	177.6	175.7	-169.6	-0.9	114	R419 L421 S426	R419-R423 WeakPolarHBondContact O-CG 3.33Å; R419-R423 PolarHBondContact O-N 3.47Å; L421-R423 PolarHBondContact O-N 3.25Å; R423-S426 PolarHBondContact O-OG 2.97Å
424	K	79.4	Confident	70.3	Confident	157 Å²	157	113.9 Å²	113.9	68%	0.683	59%	0.593	S	S	*	*	H	α-helix	trans	-76.5	-36.2	174.8	-79.1	-175.9	172	-167.3	0	111.8	K420 L421 L422 K427	K420-K424 PolarHBondContact O-N 3.41Å; L421-K424 WeakPolarHBondContact O-CB 3.49Å; L421-K424 PolarHBondContact O-N 3.35Å; L421-K424 VanDerWaalsContact O-N 3.1Å; L422-K424 VanDerWaalsContact C-N 3.27Å; L422-K424 PolarHBondContact O-N 3.06Å; K424-K427 PolarHBondContact O-N 3.28Å
425	K	67.9	Low	67.8	Low	146 Å²	146	119.2 Å²	119.2	64%	0.635	63%	0.626	S	S	*	*	H	α-helix	trans	-70.1	-33.1	179.6	-164.7	175	179.3	-178.5	0	112.4	L421 L422 K427	L421-K425 PolarHBondContact O-N 3.15Å; L421-K425 VanDerWaalsContact O-N 3.13Å; L422-K425 PolarHBondContact O-N 2.77Å; K425-K427 VanDerWaalsContact C-N 3.25Å; K425-K427 PolarHBondContact O-N 3.48Å
426	S	60.9	Low	65.6	Low	97 Å²	97	118.6 Å²	118.6	68%	0.678	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-6.4	179.3	60.3	0	0	0	0	115.1	L422 R423	L422-S426 PolarHBondContact O-N 2.99Å; L422-S426 PolarHBondContact O-OG 2.84Å; R423-S426 PolarHBondContact O-OG 2.97Å
427	K	59.2	Low	63.2	Low	194 Å²	194	121.1 Å²	121.1	84%	0.843	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-3.6	-179.5	-154.6	168.5	-178.3	176.5	0	113.8	K424 K425	K424-K427 PolarHBondContact O-N 3.28Å; K425-K427 VanDerWaalsContact C-N 3.25Å; K425-K427 PolarHBondContact O-N 3.48Å
428	G	51.3	Low	61	Low	62 Å²	62	128 Å²	128	64%	0.639	69%	0.685	S	S	*	*			trans	-105	107.8	167.6	0	0	0	0	0	109.4
429	K	53.6	Low	58.9	Low	193 Å²	193	127 Å²	127	84%	0.839	69%	0.687	S	S	*	*			trans	-97	132.1	173.4	-122.6	-178.5	179.8	-176.6	0	109.1
430	D	43.7	Very low	56.9	Low	155 Å²	155	131 Å²	131	83%	0.829	71%	0.708	S	S	*	*			trans	117.5	130.2	158.6	-59.6	-21.9	0	0	0	116.4
431	A	42.7	Very low	55.3	Low	97 Å²	97	132.6 Å²	132.6	80%	0.802	72%	0.715	S	S	*	*	S	Bend	trans	89.9	110.6	173.8	0	0	0	0	0	119.7
432	S	36.6	Very low	53.8	Low	121 Å²	121	132.9 Å²	132.9	85%	0.846	72%	0.724	S	S	*	*			trans	80.1	112.2	160.7	76.9	0	0	0	0	118.7	G434	S432-G434 PolarHBondContact O-N 3.07Å
433	V	46	Very low	53.6	Low	151 Å²	151	130.9 Å²	130.9	92%	0.915	71%	0.714	S	S	*	*			trans	-68.5	79.8	161.8	-179.5	0	0	0	0	107.8
434	G	37.4	Very low	53.6	Low	48 Å²	48	124.1 Å²	124.1	50%	0.495	69%	0.694	S	S	.	*			trans	-93.7	109	157.7	0	0	0	0	0	107.6	S432 I436	S432-G434 PolarHBondContact O-N 3.07Å; G434-I436 PolarHBondContact O-N 2.89Å
435	V	40.3	Very low	54.3	Low	126 Å²	126	116.7 Å²	116.7	76%	0.764	66%	0.662	S	S	*	*			trans	-63.9	86.3	163.2	178	0	0	0	0	106.4	T437	V435-T437 PolarHBondContact O-N 3.22Å
436	I	45.7	Very low	55.5	Low	124 Å²	124	114.7 Å²	114.7	64%	0.636	65%	0.653	S	S	*	*			trans	-75.4	92.8	167.8	-57	175.7	0	0	0	104.5	G434 I438	G434-I436 PolarHBondContact O-N 2.89Å; I436-I438 PolarHBondContact O-N 2.84Å
437	T	40.7	Very low	57.1	Low	114 Å²	114	111 Å²	111	70%	0.699	63%	0.625	S	S	*	*			trans	-45.7	114.7	158.6	26.2	0	0	0	0	106.9	V435 P439	V435-T437 PolarHBondContact O-N 3.22Å; T437-P439 WeakPolarHBondContact O-CD 3.22Å
438	I	46.7	Very low	58.8	Low	149 Å²	149	106.4 Å²	106.4	76%	0.764	61%	0.605	S	S	*	*			trans	-56.9	113.5	165.1	-64.7	172.6	0	0	0	103.8	I436 K440	I436-I438 PolarHBondContact O-N 2.84Å; I438-K440 PolarHBondContact O-N 3.45Å
439	P	46.4	Very low	60.8	Low	79 Å²	79	106.7 Å²	106.7	51%	0.513	59%	0.594	S	S	.	*			trans	-56.2	134.7	179.7	-18	29.1	0	0	0	106.2	T437 K441	T437-P439 WeakPolarHBondContact O-CD 3.22Å; P439-K441 HydrophobicContact CB-CG 4.18Å; P439-K441 PolarHBondContact O-N 3.05Å
440	K	47.5	Very low	62.7	Low	222 Å²	222	99.3 Å²	99.3	97%	0.965	56%	0.564	S	S	*	*			trans	-63.8	81.3	168.4	-156.4	178.2	-175.3	-177	0	105.5	I438 S442	I438-K440 PolarHBondContact O-N 3.45Å; K440-S442 PolarHBondContact O-N 3.49Å
441	K	57.7	Low	65	Low	145 Å²	145	98.6 Å²	98.6	63%	0.63	57%	0.565	S	S	*	*			trans	-68.7	130.3	-170.2	-80.9	-179.9	177.6	179	0	106.9	P439 D443	P439-K441 HydrophobicContact CB-CG 4.18Å; P439-K441 PolarHBondContact O-N 3.05Å; K441-D443 PolarHBondContact O-N 3.33Å
442	S	54.4	Low	67.3	Low	92 Å²	92	97.6 Å²	97.6	64%	0.643	55%	0.546	S	S	*	.			trans	-53.7	129.6	166.3	42.6	0	0	0	0	108.5	K440 V444	K440-S442 PolarHBondContact O-N 3.49Å; S442-V444 PolarHBondContact O-N 2.84Å
443	D	78.9	Confident	70	Confident	84 Å²	84	93.7 Å²	93.7	45%	0.449	52%	0.516	S	S	.	.	S	Bend	trans	-71	24.6	176.5	-77.8	-58.5	0	0	0	112.4	D242 A243 T244 K441	D242-D443 CarbonylContact C-O 3.5Å; A243-D443 CarbonylContact C-O 3.53Å; A243-D443 PolarHBondContact N-O 2.76Å; T244-D443 PolarHBondContact OG1-OD1 3.46Å; K441-D443 PolarHBondContact O-N 3.33Å
444	V	89.5	Confident	72.2	Confident	50 Å²	50	92.5 Å²	92.5	30%	0.303	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.7	-170.5	-175.5	0	0	0	0	109.8	T240 S442	T240-V444 VanDerWaalsContact CB-CG1 3.44Å; T240-V444 HydrophobicContact CG2-CG1 3.83Å; S442-V444 PolarHBondContact O-N 2.84Å
445	T	92.8	Very high	74.7	Confident	2 Å²	2	92.5 Å²	92.5	1%	0.012	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.3	174.3	-56.1	0	0	0	0	110.2	T240 L241 A243 P255 T257	T240-T445 CarbonylContact C-O 3.52Å; T240-T445 VanDerWaalsContact CA-O 3.28Å; T240-T445 WeakPolarHBondContact CA-O 3.48Å; L241-T445 PolarHBondContact N-O 3.03Å; L241-T445 PolarHBondContact O-N 3.2Å; A243-T445 PolarHBondContact O-OG1 3.19Å; P255-T445 HydrophobicContact CB-CG2 3.64Å; P255-T445 HydrophobicContact CG-CG2 4.17Å; T257-T445 WeakPolarHBondContact OG1-CB 3.45Å; T257-T445 WeakPolarHBondContact OG1-CG2 3.24Å; T257-T445 PolarHBondContact OG1-OG1 2.71Å
446	F	93.3	Very high	77.1	Confident	104 Å²	104	91.7 Å²	91.7	46%	0.456	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.1	171.6	-68	-89.8	0	0	0	111	Q238 T240 P255	Q238-F446 VanDerWaalsContact CD-CE1 3.48Å; Q238-F446 HydrophobicContact CG-CD1 3.93Å; Q238-F446 HydrophobicContact CG-CE1 4.17Å; T240-F446 HydrophobicContact CG2-CD1 3.46Å; T240-F446 VanDerWaalsContact CG2-CD1 3.46Å; T240-F446 HydrophobicContact CG2-CE1 3.42Å; T240-F446 VanDerWaalsContact CG2-CE1 3.42Å; T240-F446 HydrophobicContact CG2-CG 4.18Å; T240-F446 HydrophobicContact CG2-CZ 4.12Å; P255-F446 VanDerWaalsContact CG-O 3.3Å; P255-F446 WeakPolarHBondContact CG-O 3.41Å
447	F	95.1	Very high	79.4	Confident	19 Å²	19	87 Å²	87	8%	0.083	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-71	145.7	171.8	-75.7	-118.9	0	0	0	110	Y239 L241 I380 I382 A398 Y399	Y239-F447 HydrophobicContact CD2-CB 4.2Å; Y239-F447 HydrophobicContact CD2-CG 4.47Å; Y239-F447 WeakPolarHBondContact O-CD2 3.1Å; Y239-F447 PolarHBondContact O-N 3.33Å; L241-F447 HydrophobicContact CB-CE2 3.71Å; L241-F447 HydrophobicContact CB-CZ 4.32Å; I380-F447 HydrophobicContact CB-CE1 4.07Å; I380-F447 HydrophobicContact CB-CZ 4.29Å; I380-F447 HydrophobicContact CG2-CE1 3.82Å; I380-F447 HydrophobicContact CG2-CZ 3.97Å; I382-F447 HydrophobicContact CD1-CD1 4.09Å; I382-F447 HydrophobicContact CD1-CE1 3.65Å; I382-F447 HydrophobicContact CD1-CE2 4.27Å; I382-F447 HydrophobicContact CD1-CZ 3.75Å; I382-F447 HydrophobicContact CG1-CD1 4.36Å; I382-F447 HydrophobicContact CG1-CE1 3.9Å; I382-F447 HydrophobicContact CG1-CZ 4.41Å; A398-F447 HydrophobicContact CB-CB 3.83Å; Y399-F447 CarbonylContact O-C 3.19Å; Y399-F447 WeakPolarHBondContact O-CA 3.26Å
448	K	93.9	Very high	82	Confident	97 Å²	97	81.9 Å²	81.9	42%	0.422	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.4	174.6	-177.7	177	175.2	-175.6	0	109.6	A398 Y399	A398-K448 CarbonylContact C-O 3.56Å; A398-K448 WeakPolarHBondContact CA-O 3.4Å; A398-K448 WeakPolarHBondContact CB-O 3.39Å; Y399-K448 HydrophobicContact CD1-CB 4.27Å; Y399-K448 VanDerWaalsContact CD1-O 3.23Å; Y399-K448 WeakPolarHBondContact CD1-O 3.44Å; Y399-K448 HydrophobicContact CE1-CB 3.94Å; Y399-K448 HydrophobicContact CE1-CD 4.06Å; Y399-K448 HydrophobicContact CE1-CG 4.07Å; Y399-K448 PolarHBondContact N-O 3.44Å; Y399-K448 PolarHBondContact O-N 3.13Å
449	T	93.9	Very high	84.4	Confident	68 Å²	68	76.4 Å²	76.4	42%	0.417	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	139.5	176.1	-57.7	0	0	0	0	111.6	H396 R397	H396-T449 WeakPolarHBondContact NE2-CG2 3.39Å; H396-T449 PolarHBondContact NE2-OG1 2.92Å; H396-T449 VanDerWaalsContact NE2-OG1 3.11Å; R397-T449 WeakPolarHBondContact O-CA 3.31Å
450	I	93	Very high	86.8	Confident	38 Å²	38	72.8 Å²	72.8	20%	0.195	38%	0.378	C	S	.	.			trans	-104.2	127.9	170.4	-54.4	-175.1	0	0	0	107.4	M379 R397 Y399 D452	M379-I450 HydrophobicContact CE-CD1 4.05Å; R397-I450 HydrophobicContact CB-CB 4.24Å; R397-I450 HydrophobicContact CG-CB 3.79Å; R397-I450 HydrophobicContact CG-CD1 3.91Å; R397-I450 HydrophobicContact CG-CG1 4.08Å; R397-I450 HydrophobicContact CG-CG2 4.47Å; R397-I450 PolarHBondContact O-N 3.19Å; Y399-I450 HydrophobicContact CD1-CD1 3.54Å; Y399-I450 HydrophobicContact CD1-CG1 3.35Å; Y399-I450 HydrophobicContact CE1-CD1 4.29Å; Y399-I450 HydrophobicContact CE1-CG1 3.88Å; Y399-I450 HydrophobicContact CG-CD1 4.04Å; Y399-I450 HydrophobicContact CG-CG1 4.3Å; I450-D452 HydrophobicContact CG2-CB 4.16Å
451	T	92.4	Very high	89	Confident	140 Å²	140	64.5 Å²	64.5	86%	0.859	34%	0.344	S	S	*	.	S	Bend	trans	-79.6	-26.4	179.6	50.6	0	0	0	0	112.7	L453	T451-L453 PolarHBondContact O-N 2.83Å
452	D	92.1	Very high	90.5	Very high	76 Å²	76	57.8 Å²	57.8	41%	0.406	32%	0.315	S	S	.	.			trans	-77.2	110.6	173.7	179.8	15.2	0	0	0	111.4	R397 I450 E454 A455	R397-D452 WeakPolarHBondContact CD-O 3.37Å; R397-D452 PolarHBondContact NH1-O 3.32Å; I450-D452 HydrophobicContact CG2-CB 4.16Å; D452-E454 PolarHBondContact OD1-N 2.86Å; D452-A455 PolarHBondContact OD1-N 2.79Å; D452-A455 WeakPolarHBondContact OD2-CB 3.44Å
453	L	92.6	Very high	91.5	Very high	40 Å²	40	58.1 Å²	58.1	21%	0.209	31%	0.31	C	S	.	.			trans	-104.1	-3.6	178	-57.1	177.2	0	0	0	112.2	K393 P394 R397 T451	K393-L453 HydrophobicContact CG-CB 4.12Å; P394-L453 WeakPolarHBondContact CD-O 3.48Å; P394-L453 HydrophobicContact CG-CB 4.23Å; P394-L453 HydrophobicContact CG-CD2 4.14Å; R397-L453 HydrophobicContact CB-CD2 3.62Å; T451-L453 PolarHBondContact O-N 2.83Å
454	E	91.1	Very high	90.6	Very high	125 Å²	125	59.6 Å²	59.6	58%	0.584	32%	0.322	S	S	*	.	S	Bend	trans	-91.8	-35.2	-177	-60.3	-58.7	150.9	0	0	111.8	K393 D452 Q456	K393-E454 VanDerWaalsContact CD-OE1 3.3Å; K393-E454 WeakPolarHBondContact CD-OE1 3.49Å; K393-E454 WeakPolarHBondContact CE-OE1 3.5Å; K393-E454 IonicContact NZ-OE1 3.95Å; K393-E454 PolarHBondContact NZ-OE1 2.9Å; D452-E454 PolarHBondContact OD1-N 2.86Å; E454-Q456 PolarHBondContact O-N 2.79Å
455	A	90.9	Very high	88.9	Confident	49 Å²	49	59.3 Å²	59.3	41%	0.405	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-57.3	133.2	177.4	0	0	0	0	0	111.5	R397 D452	R397-A455 PolarHBondContact NH1-O 2.63Å; R397-A455 PolarHBondContact NH2-O 2.92Å; D452-A455 PolarHBondContact OD1-N 2.79Å; D452-A455 WeakPolarHBondContact OD2-CB 3.44Å
456	Q	91.4	Very high	86.5	Confident	108 Å²	108	65.3 Å²	65.3	51%	0.505	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-97.9	130.4	177.7	-67.1	-175.8	18.3	0	0	110.7	E454 F476	E454-Q456 PolarHBondContact O-N 2.79Å; Q456-F476 PolarHBondContact OE1-O 3.19Å
457	P	93.5	Very high	84.1	Confident	25 Å²	25	63.6 Å²	63.6	16%	0.162	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-69.4	149.7	176.8	32.1	-38.2	0	0	0	111.4	M290 V292 L459	M290-P457 HydrophobicContact CE-CB 4.03Å; M290-P457 HydrophobicContact CE-CG 3.74Å; M290-P457 HydrophobicContact SD-CB 3.31Å; M290-P457 WeakPolarHBondContact SD-CB 3.47Å; M290-P457 HydrophobicContact SD-CG 3.41Å; M290-P457 WeakPolarHBondContact SD-CG 3.05Å; V292-P457 HydrophobicContact CG1-CB 4.14Å; P457-L459 PolarHBondContact O-N 3.03Å
458	V	95.5	Very high	81.3	Confident	8 Å²	8	69.4 Å²	69.4	5%	0.048	39%	0.387	C	S	.	.			trans	-80.7	108.7	174.6	-176.9	0	0	0	0	109.7	R299 Q302 L303 N342	R299-V458 HydrophobicContact CB-CG2 4.29Å; R299-V458 HydrophobicContact CG-CG1 4.29Å; R299-V458 HydrophobicContact CG-CG2 4.13Å; Q302-V458 HydrophobicContact CB-CB 4.2Å; Q302-V458 HydrophobicContact CB-CG1 4.04Å; Q302-V458 HydrophobicContact CB-CG2 4.14Å; Q302-V458 HydrophobicContact CG-CG2 4.35Å; L303-V458 HydrophobicContact CD2-CG1 3.75Å; L303-V458 HydrophobicContact CG-CG1 3.83Å; N342-V458 PolarHBondContact ND2-O 2.97Å; N342-V458 VanDerWaalsContact ND2-O 3.12Å
459	L	96.4	Very high	79	Confident	34 Å²	34	67 Å²	67	18%	0.178	38%	0.378	C	S	.	.			trans	-90.3	131.5	173.5	-59.4	-173.8	0	0	0	110.7	M290 I339 A340 A343 P457	M290-L459 HydrophobicContact SD-CD2 4.48Å; I339-L459 HydrophobicContact CD1-CD1 4.27Å; A340-L459 HydrophobicContact CB-CB 3.86Å; A340-L459 HydrophobicContact CB-CD2 4.39Å; A340-L459 HydrophobicContact CB-CG 4.49Å; A343-L459 HydrophobicContact CB-CD2 3.65Å; P457-L459 PolarHBondContact O-N 3.03Å
460	F	96.7	Very high	76.6	Confident	3 Å²	3	70.4 Å²	70.4	1%	0.013	39%	0.389	C	S	.	.			trans	-100.8	117.2	179.5	175.7	-119.7	0	0	0	111.4	L303 W306 K307 H310 Y341 N342 P462	L303-F460 HydrophobicContact CD2-CD2 4.28Å; W306-F460 HydrophobicContact CB-CB 3.91Å; W306-F460 HydrophobicContact CB-CD1 3.89Å; W306-F460 HydrophobicContact CB-CD2 3.56Å; W306-F460 HydrophobicContact CB-CE1 4.31Å; W306-F460 HydrophobicContact CB-CE2 4.01Å; W306-F460 HydrophobicContact CB-CG 3.49Å; W306-F460 VanDerWaalsContact CB-CG 3.49Å; W306-F460 HydrophobicContact CB-CZ 4.36Å; W306-F460 HydrophobicContact CD2-CB 4.44Å; W306-F460 HydrophobicContact CG-CB 3.8Å; W306-F460 HydrophobicContact CG-CD1 4.4Å; W306-F460 HydrophobicContact CG-CD2 4.37Å; W306-F460 AromaticContact CG-CG 3.94Å; W306-F460 HydrophobicContact CG-CG 3.94Å; K307-F460 HydrophobicContact CG-CE2 3.85Å; H310-F460 HydrophobicContact CB-CE1 3.74Å; H310-F460 HydrophobicContact CB-CZ 3.7Å; H310-F460 AromaticContact CG-CE1 3.94Å; H310-F460 AromaticContact CG-CZ 3.95Å; Y341-F460 HydrophobicContact CG-CD1 4.48Å; Y341-F460 PolarHBondContact N-O 2.86Å; N342-F460 PolarHBondContact OD1-N 2.87Å; F460-P462 HydrophobicContact CE1-CB 4.26Å; F460-P462 HydrophobicContact CE1-CG 4.35Å; F460-P462 HydrophobicContact CE2-CB 4.41Å; F460-P462 HydrophobicContact CZ-CB 3.8Å; F460-P462 HydrophobicContact CZ-CG 4.37Å
461	I	94.6	Very high	74.3	Confident	48 Å²	48	77.2 Å²	77.2	25%	0.246	41%	0.412	C	S	.	.			trans	-125.1	109.2	174.9	-62	164.8	0	0	0	106.4	A340 L469	A340-I461 HydrophobicContact CB-CG1 4.03Å; I461-L469 HydrophobicContact CB-CD2 4.1Å; I461-L469 HydrophobicContact CD1-CD2 3.73Å; I461-L469 HydrophobicContact CG1-CD2 3.57Å; I461-L469 HydrophobicContact CG2-CB 4.49Å; I461-L469 HydrophobicContact CG2-CD2 3.43Å; I461-L469 VanDerWaalsContact CG2-CD2 3.43Å
462	P	88	Confident	71.9	Confident	3 Å²	3	71.7 Å²	71.7	2%	0.019	38%	0.381	C	S	.	.			trans	-68.8	142	-177.7	24.7	-30.8	0	0	0	111.9	Y341 F460 V464 H465	Y341-P462 HydrophobicContact CD1-CG 4.04Å; Y341-P462 HydrophobicContact CD2-CG 3.79Å; Y341-P462 HydrophobicContact CE1-CG 3.79Å; Y341-P462 HydrophobicContact CE2-CG 3.52Å; Y341-P462 HydrophobicContact CG-CG 4.05Å; F460-P462 HydrophobicContact CE1-CB 4.26Å; F460-P462 HydrophobicContact CE1-CG 4.35Å; F460-P462 HydrophobicContact CE2-CB 4.41Å; F460-P462 HydrophobicContact CZ-CB 3.8Å; F460-P462 HydrophobicContact CZ-CG 4.37Å; P462-V464 HydrophobicContact CB-CG2 4.49Å; P462-V464 PolarHBondContact O-N 2.75Å; P462-H465 PolarHBondContact O-N 3.36Å; P462-H465 VanDerWaalsContact O-N 3.08Å
463	D	76.3	Confident	69.4	Low	99 Å²	99	69.3 Å²	69.3	53%	0.529	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-57.2	-26.6	-171.9	-62.3	-43.3	0	0	0	113.6	K307 H465 F466	K307-D463 IonicContact NZ-OD2 2.71Å; K307-D463 PolarHBondContact NZ-OD2 2.87Å; D463-H465 PolarHBondContact O-N 2.83Å; D463-H465 VanDerWaalsContact O-N 3.1Å; D463-F466 HydrophobicContact CB-CD2 4.39Å; D463-F466 HydrophobicContact CB-CE2 4.34Å; D463-F466 WeakPolarHBondContact O-CD2 3.2Å; D463-F466 PolarHBondContact O-N 3.32Å; D463-F466 WeakPolarHBondContact OD1-CE2 3.29Å
464	V	59.2	Low	66.8	Low	116 Å²	116	75 Å²	75	70%	0.703	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-65.9	-11.1	179.5	-131.2	0	0	0	0	114.2	P462	P462-V464 HydrophobicContact CB-CG2 4.49Å; P462-V464 PolarHBondContact O-N 2.75Å
465	H	54.1	Low	64.4	Low	44 Å²	44	72 Å²	72	20%	0.204	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-118.5	13	-176.8	-65.1	91.4	0	0	0	114.5	Y341 P462 D463 G467 N468 L469	Y341-H465 PolarHBondContact OH-CE1 3.14Å; Y341-H465 PolarHBondContact OH-ND1 3.14Å; Y341-H465 PolarHBondContact OH-NE2 3.02Å; P462-H465 PolarHBondContact O-N 3.36Å; P462-H465 VanDerWaalsContact O-N 3.08Å; D463-H465 PolarHBondContact O-N 2.83Å; D463-H465 VanDerWaalsContact O-N 3.1Å; H465-G467 PolarHBondContact O-N 3.1Å; H465-N468 PolarHBondContact O-N 3.27Å; H465-L469 PolarHBondContact O-N 2.8Å
466	F	43.1	Very low	61.9	Low	128 Å²	128	71.7 Å²	71.7	56%	0.561	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.7	179.8	-93.8	-103.5	0	0	0	114.5	D463	D463-F466 HydrophobicContact CB-CD2 4.39Å; D463-F466 HydrophobicContact CB-CE2 4.34Å; D463-F466 WeakPolarHBondContact O-CD2 3.2Å; D463-F466 PolarHBondContact O-N 3.32Å; D463-F466 WeakPolarHBondContact OD1-CE2 3.29Å
467	G	42.2	Very low	58.9	Low	67 Å²	67	71.2 Å²	71.2	69%	0.691	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-27.2	172.3	0	0	0	0	0	114.4	H465	H465-G467 PolarHBondContact O-N 3.1Å
468	N	37.1	Very low	55.9	Low	142 Å²	142	77.6 Å²	77.6	76%	0.759	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-12.4	-167.1	-65	-2.5	0	0	0	113.9	H465	H465-N468 PolarHBondContact O-N 3.27Å
469	L	45.2	Very low	52.7	Low	47 Å²	47	83.2 Å²	83.2	25%	0.246	44%	0.439	C	S	.	.			trans	-113.7	26.4	-173	-151.9	70.9	0	0	0	114.4	I461 H465 R471	I461-L469 HydrophobicContact CB-CD2 4.1Å; I461-L469 HydrophobicContact CD1-CD2 3.73Å; I461-L469 HydrophobicContact CG1-CD2 3.57Å; I461-L469 HydrophobicContact CG2-CB 4.49Å; I461-L469 HydrophobicContact CG2-CD2 3.43Å; I461-L469 VanDerWaalsContact CG2-CD2 3.43Å; H465-L469 PolarHBondContact O-N 2.8Å; L469-R471 PolarHBondContact O-N 2.92Å; L469-R471 VanDerWaalsContact O-N 3.13Å
470	Q	44.3	Very low	49.5	Very low	138 Å²	138	86.8 Å²	86.8	65%	0.645	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-0.3	175.4	-76.2	-162.9	5.6	0	0	114.4
471	R	42.9	Very low	46.5	Very low	182 Å²	182	95.5 Å²	95.5	69%	0.687	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-14.1	-176.2	-137.4	179.9	-72.7	-137.8	6.5	115.3	L469 S582	L469-R471 PolarHBondContact O-N 2.92Å; L469-R471 VanDerWaalsContact O-N 3.13Å; R471-S582 VanDerWaalsContact CZ-CB 3.48Å; R471-S582 VanDerWaalsContact CZ-OG 3.24Å; R471-S582 PolarHBondContact NH1-OG 2.7Å; R471-S582 PolarHBondContact NH2-OG 2.96Å
472	A	42.9	Very low	43.4	Very low	23 Å²	23	101.6 Å²	101.6	19%	0.19	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-12.7	-173.4	0	0	0	0	0	116.1	I339	I339-A472 HydrophobicContact CB-CB 3.67Å; I339-A472 HydrophobicContact CG2-CB 3.63Å
473	G	38.6	Very low	40.8	Very low	27 Å²	27	109.3 Å²	109.3	28%	0.278	58%	0.582	S	S	.	*	S	Bend	trans	-86	-10.8	-175	0	0	0	0	0	116.1	V475 T477	G473-V475 VanDerWaalsContact C-N 3.29Å; G473-V475 PolarHBondContact O-N 2.98Å; G473-T477 PolarHBondContact O-OG1 3.49Å
474	Q	38.4	Very low	38.7	Very low	159 Å²	159	112.5 Å²	112.5	74%	0.743	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	6.3	-169.5	-68.2	-155.2	-49.1	0	0	115.4
475	V	42	Very low	37.6	Very low	63 Å²	63	118.5 Å²	118.5	38%	0.382	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.8	-14.6	178	-170.4	0	0	0	0	112.3	N392 G473	N392-V475 VanDerWaalsContact CG-O 3.31Å; N392-V475 PolarHBondContact ND2-O 3.38Å; N392-V475 VanDerWaalsContact ND2-O 3.17Å; N392-V475 WeakPolarHBondContact OD1-CG1 3.31Å; G473-V475 VanDerWaalsContact C-N 3.29Å; G473-V475 PolarHBondContact O-N 2.98Å
476	F	37.3	Very low	36.5	Very low	41 Å²	41	126.1 Å²	126.1	18%	0.18	64%	0.644	C	S	.	*	S	Bend	trans	-129.8	21	-174.6	-64	-75.1	0	0	0	114.7	Y385 N392 Q456	Y385-F476 HydrophobicContact CE1-CZ 4.11Å; Y385-F476 AromaticContact CZ-CZ 3.87Å; Y385-F476 WeakPolarHBondContact OH-CZ 3.18Å; N392-F476 HydrophobicContact CB-CE1 4.44Å; Q456-F476 PolarHBondContact OE1-O 3.19Å
477	T	29.1	Very low	35.8	Very low	98 Å²	98	123.9 Å²	123.9	60%	0.601	66%	0.657	S	S	*	*			trans	-120	99.4	170.7	39.8	0	0	0	0	109.2	G473	G473-T477 PolarHBondContact O-OG1 3.49Å
478	F	29.5	Very low	35.2	Very low	160 Å²	160	125.8 Å²	125.8	70%	0.702	66%	0.66	S	S	*	*			trans	-113.4	131.4	163.4	-95.2	-77.9	0	0	0	110.3
479	N	28.1	Very low	34.8	Very low	125 Å²	125	125.8 Å²	125.8	67%	0.668	67%	0.665	S	S	*	*			trans	48.3	93.4	146.7	-66.6	-12.7	0	0	0	118.7
480	A	30.6	Very low	34.2	Very low	109 Å²	109	130.6 Å²	130.6	90%	0.901	69%	0.69	S	S	*	*	S	Bend	trans	-101.5	37.7	154.7	0	0	0	0	0	111.2
481	E	33	Very low	33.5	Very low	187 Å²	187	130.5 Å²	130.5	87%	0.874	70%	0.698	S	S	*	*			trans	-118.5	10.6	-179.9	-71.1	-157.6	157.2	0	0	114.9
482	E	29.6	Very low	33	Very low	175 Å²	175	129.6 Å²	129.6	82%	0.818	70%	0.699	S	S	*	*	S	Bend	trans	-121.7	25.1	-174.4	-139.9	178.2	-171.5	0	0	116.1
483	I	34.3	Very low	32.2	Very low	166 Å²	166	140.6 Å²	140.6	85%	0.851	74%	0.736	S	S	*	*	S	Bend	trans	-136.3	49.9	172.6	-50.9	175.9	0	0	0	111.1
484	D	31.3	Very low	31.7	Very low	165 Å²	165	145.3 Å²	145.3	88%	0.882	75%	0.752	S	S	*	*			trans	-148.1	43.1	169	-117.1	-6.8	0	0	0	113.6
485	R	35.5	Very low	31.2	Very low	243 Å²	243	147.1 Å²	147.1	92%	0.917	76%	0.758	S	S	*	*			trans	-132.1	82.6	166.2	-91	-172.7	170.5	-173	-0.8	110.8
486	E	31.7	Very low	30.8	Very low	204 Å²	204	155 Å²	155	95%	0.953	78%	0.781	S	S	*	*	S	Bend	trans	170.8	120.4	130.7	-97.5	176.3	172.4	0	0	109.9
487	G	27.7	Very low	30.8	Very low	81 Å²	81	158.6 Å²	158.6	84%	0.835	81%	0.808	S	S	*	*			trans	155.1	58.3	175.1	0	0	0	0	0	114.9
488	S	29.5	Very low	30.8	Very low	107 Å²	107	159.4 Å²	159.4	75%	0.748	81%	0.813	S	S	*	*			trans	-71.9	120.9	170.4	159	0	0	0	0	111.2
489	V	28.6	Very low	30.9	Very low	141 Å²	141	158.4 Å²	158.4	86%	0.855	82%	0.815	S	S	*	*			trans	-144.6	118	146.5	-174.4	0	0	0	0	110.7
490	L	33.6	Very low	31.1	Very low	149 Å²	149	161.1 Å²	161.1	78%	0.78	82%	0.824	S	S	*	*			trans	-57	150.2	169.1	-69.9	136.8	0	0	0	112.1
491	V	30.1	Very low	31.2	Very low	135 Å²	135	162.9 Å²	162.9	82%	0.818	82%	0.818	S	S	*	*				-174	107.1	120	172.7	0	0	0	0	110.7
492	K	31.8	Very low	31.2	Very low	163 Å²	163	161.5 Å²	161.5	71%	0.709	82%	0.816	S	S	*	*				42.4	113.7	125.5	-149.5	176.2	-174.4	176.5	0	119.6	M494	K492-M494 HydrophobicContact CG-CG 4.32Å
493	R	26.9	Very low	31.1	Very low	254 Å²	254	159.1 Å²	159.1	96%	0.958	82%	0.817	S	S	*	*			trans	-132.5	117.2	143.3	-152.9	174.2	-146.7	132.8	3.9	110
494	M	28.3	Very low	31	Very low	127 Å²	127	157.4 Å²	157.4	63%	0.626	82%	0.817	S	S	*	*			trans	-88.6	148.4	177.1	-74.1	-168.7	154.1	0	0	111.1	K492	K492-M494 HydrophobicContact CG-CG 4.32Å
495	F	27.9	Very low	30.8	Very low	196 Å²	196	154.7 Å²	154.7	86%	0.86	81%	0.811	S	S	*	*			trans	142.2	120.7	130.5	-86.7	-82	0	0	0	113.2
496	R	32.3	Very low	30.8	Very low	230 Å²	230	148.5 Å²	148.5	87%	0.868	80%	0.802	S	S	*	*			trans	-95.1	161.9	152.1	-88	-172.2	174.9	-179.2	-2.3	108.4
497	P	38	Very low	30.9	Very low	116 Å²	116	147.2 Å²	147.2	75%	0.753	80%	0.796	S	S	*	*				-136.3	134.1	94.3	9.9	14.2	0	0	0	113.7
498	T	28.7	Very low	31.6	Very low	114 Å²	114	153.7 Å²	153.7	70%	0.699	80%	0.801	S	S	*	*				66.5	132.5	110.9	19.2	0	0	0	0	115.1
499	D	31.9	Very low	31.8	Very low	140 Å²	140	156.8 Å²	156.8	75%	0.749	80%	0.804	S	S	*	*			cis	-161.1	159.7	42.9	-98.1	-39	0	0	0	114
500	E	32.4	Very low	31.8	Very low	182 Å²	182	155.4 Å²	155.4	85%	0.85	80%	0.8	S	S	*	*			trans	63.6	150	154.2	-69.8	-167.7	164.2	0	0	123.2
501	D	33	Very low	31.8	Very low	146 Å²	146	160.1 Å²	160.1	78%	0.781	81%	0.807	S	S	*	*				-153.6	156.2	-67	-138.3	-19.8	0	0	0	106.8
502	L	31.4	Very low	32	Very low	158 Å²	158	160.7 Å²	160.7	83%	0.827	80%	0.801	S	S	*	*			trans	81	91.9	164.7	-49.8	174.9	0	0	0	121.2
503	C	28	Very low	32.2	Very low	125 Å²	125	161 Å²	161	85%	0.845	81%	0.805	S	S	*	*			trans	-153.6	127	141.6	-106.4	0	0	0	0	109.3	S505	C503-S505 PolarHBondContact O-N 3.31Å
504	P	33.3	Very low	32.9	Very low	130 Å²	130	155.5 Å²	155.5	84%	0.844	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.9	116.6	177.2	30.2	-29.2	0	0	0	110.1
505	S	26.9	Very low	34.1	Very low	108 Å²	108	154.9 Å²	154.9	76%	0.755	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.5	134.8	169.6	161.6	0	0	0	0	109.8	C503	C503-S505 PolarHBondContact O-N 3.31Å
506	P	35.1	Very low	36.2	Very low	112 Å²	112	151.2 Å²	151.2	73%	0.727	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-70.7	148.7	173.1	31.1	-31.3	0	0	0	109.7
507	H	33.7	Very low	38.8	Very low	178 Å²	178	148.2 Å²	148.2	82%	0.824	77%	0.768	S	S	*	*			trans	-44.3	139.6	-176.7	-65.7	-83.3	0	0	0	114.4	Q509	H507-Q509 PolarHBondContact O-N 2.63Å
508	K	42.6	Very low	41.4	Very low	217 Å²	217	143 Å²	143	94%	0.943	73%	0.733	S	S	*	*			trans	-44.5	104	158.1	-77.8	176.7	173.5	178.2	0	109.3
509	Q	32.7	Very low	44.6	Very low	172 Å²	172	139 Å²	139	80%	0.804	71%	0.708	S	S	*	*			trans	-97.1	125.7	155	-72.4	-176.1	-4.5	0	0	106.9	H507 R511	H507-Q509 PolarHBondContact O-N 2.63Å; Q509-R511 PolarHBondContact O-N 3.03Å
510	S	30.1	Very low	47.7	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	67%	0.672	S	S	*	*			trans	-37.7	130.9	165.4	44.3	0	0	0	0	110.4	E512	S510-E512 PolarHBondContact O-N 2.87Å
511	R	33.3	Very low	50.8	Low	247 Å²	247	127 Å²	127	93%	0.932	65%	0.645	S	S	*	*			trans	-44.7	101	171.6	-173.9	178.5	178.8	-174.6	-2.4	109	Q509 E513	Q509-R511 PolarHBondContact O-N 3.03Å; R511-E513 PolarHBondContact O-N 3.21Å
512	E	33.3	Very low	53.8	Low	147 Å²	147	120 Å²	120	69%	0.687	61%	0.608	S	S	*	*			trans	-63.6	117.9	179.3	-166.3	173.2	-179.3	0	0	107.5	S510 T514	S510-E512 PolarHBondContact O-N 2.87Å; E512-T514 PolarHBondContact O-N 3.35Å; E512-T514 VanDerWaalsContact O-N 3.16Å
513	E	37.1	Very low	56.9	Low	170 Å²	170	115.8 Å²	115.8	79%	0.794	58%	0.581	S	S	*	*			trans	-47.1	116.7	170.5	-167.3	166.5	-163.7	0	0	107.8	R511 H515	R511-E513 PolarHBondContact O-N 3.21Å; E513-H515 VanDerWaalsContact C-N 3.35Å; E513-H515 PolarHBondContact O-CD2 2.84Å; E513-H515 PolarHBondContact O-N 3.19Å
514	T	40.6	Very low	60	Low	138 Å²	138	113.9 Å²	113.9	85%	0.847	56%	0.558	S	S	*	*			trans	-65.3	95.4	-172.9	47.6	0	0	0	0	109.5	E512 K516	E512-T514 PolarHBondContact O-N 3.35Å; E512-T514 VanDerWaalsContact O-N 3.16Å; T514-K516 PolarHBondContact O-N 3.49Å
515	H	54.4	Low	62.6	Low	115 Å²	115	116 Å²	116	53%	0.532	56%	0.556	S	S	.	*			trans	-53.4	122.6	177.1	-70.8	-109.9	0	0	0	109.3	E513 R517	E513-H515 VanDerWaalsContact C-N 3.35Å; E513-H515 PolarHBondContact O-CD2 2.84Å; E513-H515 PolarHBondContact O-N 3.19Å; H515-R517 PolarHBondContact O-N 3.15Å
516	K	71.1	Confident	65.6	Low	119 Å²	119	116.6 Å²	116.6	52%	0.517	56%	0.556	S	S	.	*			trans	-66.2	90	180	-170.1	-176.2	-178.3	-168.4	0	109.6	T514 P538	T514-K516 PolarHBondContact O-N 3.49Å; K516-P538 VanDerWaalsContact O-CD 3.26Å; K516-P538 WeakPolarHBondContact O-CD 3.36Å; K516-P538 WeakPolarHBondContact O-CG 3.39Å
517	R	87.2	Confident	68.3	Low	167 Å²	167	113.9 Å²	113.9	63%	0.63	54%	0.535	S	S	*	.			trans	-72.7	145.2	177.4	-59.1	-177.4	-172	-170.2	1.5	110.4	H515 M534 L535	H515-R517 PolarHBondContact O-N 3.15Å; R517-M534 HydrophobicContact CB-SD 4.12Å; R517-L535 WeakPolarHBondContact CA-O 2.87Å
518	V	93.3	Very high	70.9	Confident	5 Å²	5	114 Å²	114	3%	0.03	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	129.9	179.3	178.5	0	0	0	0	109.8	L520 L535 P538 N583	V518-L520 HydrophobicContact CG1-CD2 3.68Å; V518-L520 HydrophobicContact CG1-CG 4.38Å; V518-L535 HydrophobicContact CB-CB 4.46Å; V518-L535 PolarHBondContact N-O 2.82Å; V518-L535 VanDerWaalsContact N-O 3.15Å; V518-L535 WeakPolarHBondContact O-CB 3.23Å; V518-L535 PolarHBondContact O-N 2.89Å; V518-P538 HydrophobicContact CG2-CB 3.91Å; V518-N583 WeakPolarHBondContact CA-OD1 3.46Å
519	L	94.9	Very high	73.4	Confident	32 Å²	32	108.9 Å²	108.9	17%	0.168	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.3	174.8	-178.4	61.6	0	0	0	109.9	Y521 A532 L533 M534 N583 E584	L519-Y521 HydrophobicContact CD2-CE1 3.95Å; L519-Y521 HydrophobicContact CG-CE1 4.2Å; L519-A532 HydrophobicContact CD1-CB 3.75Å; L519-L533 CarbonylContact C-O 3.52Å; L519-L533 WeakPolarHBondContact CA-O 2.97Å; L519-M534 HydrophobicContact CB-CE 4.07Å; L519-M534 HydrophobicContact CB-SD 4.4Å; L519-M534 HydrophobicContact CD1-CB 4.4Å; L519-M534 HydrophobicContact CD1-CE 3.88Å; L519-M534 HydrophobicContact CG-CE 4.39Å; L519-N583 PolarHBondContact N-OD1 2.94Å; L519-N583 CarbonylContact O-C 3.55Å; L519-N583 WeakPolarHBondContact O-CA 3.5Å; L519-E584 PolarHBondContact O-N 3.34Å
520	L	96.9	Very high	76.4	Confident	0 Å²	0	104.7 Å²	104.7	0%	0	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	146.1	174.3	-50.7	179.3	0	0	0	110.2	V518 V522 L533 L535 L543 Y581 D585 F587	V518-L520 HydrophobicContact CG1-CD2 3.68Å; V518-L520 HydrophobicContact CG1-CG 4.38Å; L520-V522 HydrophobicContact CB-CG2 4.1Å; L520-L533 HydrophobicContact CB-CB 4.34Å; L520-L533 PolarHBondContact N-O 2.78Å; L520-L533 PolarHBondContact O-N 2.85Å; L520-L535 HydrophobicContact CD1-CD1 3.78Å; L520-L535 HydrophobicContact CD1-CD2 4.2Å; L520-L535 HydrophobicContact CG-CD1 3.96Å; L520-L543 HydrophobicContact CD1-CD1 3.94Å; L520-Y581 HydrophobicContact CD1-CD2 4.02Å; L520-Y581 HydrophobicContact CD1-CE2 4.33Å; L520-Y581 HydrophobicContact CD2-CD2 4.38Å; L520-Y581 HydrophobicContact CD2-CG 4.25Å; L520-D585 HydrophobicContact CD2-CB 4.07Å; L520-F587 HydrophobicContact CD1-CE2 4.46Å; L520-F587 HydrophobicContact CD2-CE2 4.29Å
521	Y	97.2	Very high	79.5	Confident	68 Å²	68	101.2 Å²	101.2	27%	0.267	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.5	172.3	-67.5	-36.3	0	0	0	109.8	L519 D531 A532 E584 D585 T586 F587	L519-Y521 HydrophobicContact CD2-CE1 3.95Å; L519-Y521 HydrophobicContact CG-CE1 4.2Å; Y521-D531 WeakPolarHBondContact CA-O 3.35Å; Y521-A532 HydrophobicContact CD1-CB 4.5Å; Y521-A532 HydrophobicContact CE1-CB 4.42Å; Y521-E584 HydrophobicContact CD2-CB 3.8Å; Y521-E584 HydrophobicContact CD2-CG 4.31Å; Y521-E584 HydrophobicContact CE2-CB 3.42Å; Y521-E584 VanDerWaalsContact CE2-CB 3.42Å; Y521-E584 HydrophobicContact CE2-CG 3.48Å; Y521-E584 VanDerWaalsContact CE2-CG 3.48Å; Y521-E584 PolarHBondContact OH-OE1 2.7Å; Y521-D585 PolarHBondContact N-O 2.93Å; Y521-T586 HydrophobicContact CD2-CG2 4.3Å; Y521-T586 CarbonylContact O-C 3.6Å; Y521-T586 VanDerWaalsContact O-CA 3.23Å; Y521-T586 WeakPolarHBondContact O-CA 3.36Å; Y521-F587 PolarHBondContact O-N 3.29Å
522	V	96.6	Very high	82.5	Confident	0 Å²	0	92 Å²	92	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.7	-170.6	-176.9	0	0	0	0	109.9	L520 D531 L533 Y551 F587 L589 L602	L520-V522 HydrophobicContact CB-CG2 4.1Å; V522-D531 PolarHBondContact N-O 3.4Å; V522-D531 WeakPolarHBondContact O-CA 3.5Å; V522-D531 WeakPolarHBondContact O-CB 3.44Å; V522-D531 PolarHBondContact O-N 3.49Å; V522-L533 HydrophobicContact CB-CD1 3.92Å; V522-L533 HydrophobicContact CB-CG 4.27Å; V522-L533 HydrophobicContact CG1-CD1 4.34Å; V522-L533 HydrophobicContact CG2-CD1 3.58Å; V522-L533 HydrophobicContact CG2-CG 4.12Å; V522-Y551 PolarHBondContact O-OH 2.86Å; V522-F587 WeakPolarHBondContact CA-O 3.45Å; V522-F587 HydrophobicContact CG2-CB 4.35Å; V522-F587 HydrophobicContact CG2-CD2 4.41Å; V522-L589 HydrophobicContact CG1-CB 3.38Å; V522-L589 HydrophobicContact CG1-CD2 4.01Å; V522-L589 HydrophobicContact CG1-CG 4.18Å; V522-L602 HydrophobicContact CG1-CD2 4.17Å; V522-L602 HydrophobicContact CG2-CD2 4.45Å
523	R	95.6	Very high	85.5	Confident	70 Å²	70	85.1 Å²	85.1	26%	0.264	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	156.1	173.2	69.1	-179.3	-177	139.7	-4	111.2	D527 V529 F530 F587 I588 L589	R523-D527 HydrophobicContact CB-CB 4.46Å; R523-D527 WeakPolarHBondContact CD-O 3.37Å; R523-D527 PolarHBondContact NH1-O 3.28Å; R523-V529 WeakPolarHBondContact CB-O 3.44Å; R523-F530 HydrophobicContact CB-CD1 3.89Å; R523-F530 HydrophobicContact CB-CE1 4.27Å; R523-F530 HydrophobicContact CB-CG 4.2Å; R523-F530 VanDerWaalsContact CD-CZ 3.5Å; R523-F530 HydrophobicContact CG-CD1 3.79Å; R523-F530 HydrophobicContact CG-CE1 3.63Å; R523-F530 HydrophobicContact CG-CG 4.33Å; R523-F530 HydrophobicContact CG-CZ 4.03Å; R523-F587 PolarHBondContact N-O 3.27Å; R523-F587 VanDerWaalsContact N-O 3.07Å; R523-I588 HydrophobicContact CG-CD1 3.55Å; R523-I588 VanDerWaalsContact NE-CD1 3.33Å; R523-I588 CarbonylContact O-C 3.58Å; R523-I588 VanDerWaalsContact O-CA 3.28Å; R523-I588 WeakPolarHBondContact O-CA 2.98Å; R523-L589 PolarHBondContact O-N 3.06Å
524	K	93.4	Very high	88.2	Confident	84 Å²	84	81.7 Å²	81.7	37%	0.365	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	159.6	167.3	-60.7	175.4	-179.7	173.5	0	109.7	T526 D527	K524-T526 PolarHBondContact O-N 3.03Å; K524-D527 HydrophobicContact CB-CB 4.44Å; K524-D527 WeakPolarHBondContact CB-OD2 3.48Å; K524-D527 PolarHBondContact O-N 3.19Å
525	E	88.9	Confident	90.7	Very high	174 Å²	174	75.2 Å²	75.2	81%	0.813	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.2	179.8	-170.4	169.1	-162.1	0	0	112.8	I588	E525-I588 HydrophobicContact CB-CG2 3.93Å
526	T	88.6	Confident	92.3	Very high	122 Å²	122	76.2 Å²	76.2	75%	0.748	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.3	177.4	52.9	0	0	0	0	114.4	K524	K524-T526 PolarHBondContact O-N 3.03Å
527	D	92	Very high	93.1	Very high	54 Å²	54	72.3 Å²	72.3	29%	0.289	36%	0.355	S	S	.	.			trans	-102.5	137.8	-168.5	-58.8	-8.2	0	0	0	110.2	R523 K524	R523-D527 HydrophobicContact CB-CB 4.46Å; R523-D527 WeakPolarHBondContact CD-O 3.37Å; R523-D527 PolarHBondContact NH1-O 3.28Å; K524-D527 HydrophobicContact CB-CB 4.44Å; K524-D527 WeakPolarHBondContact CB-OD2 3.48Å; K524-D527 PolarHBondContact O-N 3.19Å
528	E	89.6	Confident	93.3	Very high	182 Å²	182	65.2 Å²	65.2	85%	0.85	33%	0.331	S	S	*	.	S	Bend	trans	-85.4	-19.7	178.7	-64.8	-173.5	169.1	0	0	113.1
529	V	94.1	Very high	93.4	Very high	108 Å²	108	66.6 Å²	66.6	66%	0.655	34%	0.339	S	S	*	.	S	Bend	trans	-110.3	147.8	-175.1	-63.7	0	0	0	0	111.3	R523	R523-V529 WeakPolarHBondContact CB-O 3.44Å
530	F	96.4	Very high	93.4	Very high	84 Å²	84	66.8 Å²	66.8	37%	0.368	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-93.5	138.1	175.7	-68.8	-96.5	0	0	0	111.5	R523 T586 I605	R523-F530 HydrophobicContact CB-CD1 3.89Å; R523-F530 HydrophobicContact CB-CE1 4.27Å; R523-F530 HydrophobicContact CB-CG 4.2Å; R523-F530 VanDerWaalsContact CD-CZ 3.5Å; R523-F530 HydrophobicContact CG-CD1 3.79Å; R523-F530 HydrophobicContact CG-CE1 3.63Å; R523-F530 HydrophobicContact CG-CG 4.33Å; R523-F530 HydrophobicContact CG-CZ 4.03Å; F530-T586 HydrophobicContact CE1-CG2 4.26Å; F530-I605 HydrophobicContact CE1-CD1 3.81Å; F530-I605 HydrophobicContact CZ-CD1 3.84Å
531	D	95.4	Very high	93.3	Very high	40 Å²	40	73.9 Å²	73.9	21%	0.214	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	140	166	-72.2	-54.4	0	0	0	111	Y521 V522 K550 Y551	Y521-D531 WeakPolarHBondContact CA-O 3.35Å; V522-D531 PolarHBondContact N-O 3.4Å; V522-D531 WeakPolarHBondContact O-CA 3.5Å; V522-D531 WeakPolarHBondContact O-CB 3.44Å; V522-D531 PolarHBondContact O-N 3.49Å; D531-K550 HydrophobicContact CB-CD 4.5Å; D531-K550 HydrophobicContact CB-CG 4.49Å; D531-K550 WeakPolarHBondContact OD1-CE 3.38Å; D531-K550 IonicContact OD1-NZ 3.85Å; D531-K550 PolarHBondContact OD1-NZ 3.16Å; D531-Y551 WeakPolarHBondContact CB-OH 3.44Å; D531-Y551 WeakPolarHBondContact OD2-CE1 3.39Å; D531-Y551 PolarHBondContact OD2-OH 3.17Å
532	A	95.7	Very high	93.1	Very high	53 Å²	53	70.8 Å²	70.8	44%	0.438	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.6	168	0	0	0	0	0	110.8	L519 Y521	L519-A532 HydrophobicContact CD1-CB 3.75Å; Y521-A532 HydrophobicContact CD1-CB 4.5Å; Y521-A532 HydrophobicContact CE1-CB 4.42Å
533	L	95.6	Very high	93.1	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.016	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107.8	168.9	-66	-175.6	0	0	0	109.6	L519 L520 V522 L535 I547 K550 Y551	L519-L533 CarbonylContact C-O 3.52Å; L519-L533 WeakPolarHBondContact CA-O 2.97Å; L520-L533 HydrophobicContact CB-CB 4.34Å; L520-L533 PolarHBondContact N-O 2.78Å; L520-L533 PolarHBondContact O-N 2.85Å; V522-L533 HydrophobicContact CB-CD1 3.92Å; V522-L533 HydrophobicContact CB-CG 4.27Å; V522-L533 HydrophobicContact CG1-CD1 4.34Å; V522-L533 HydrophobicContact CG2-CD1 3.58Å; V522-L533 HydrophobicContact CG2-CG 4.12Å; L533-L535 HydrophobicContact CB-CD1 4.27Å; L533-I547 HydrophobicContact CD1-CG1 3.86Å; L533-K550 HydrophobicContact CD2-CB 3.49Å; L533-K550 VanDerWaalsContact CD2-CB 3.49Å; L533-K550 HydrophobicContact CD2-CD 4.46Å; L533-K550 HydrophobicContact CD2-CG 3.72Å; L533-Y551 HydrophobicContact CD1-CE2 4.33Å; L533-Y551 HydrophobicContact CD2-CE2 4.06Å
534	M	94.2	Very high	93	Very high	98 Å²	98	69.1 Å²	69.1	48%	0.483	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	108.6	176.2	-176.8	64.3	70.1	0	0	110.2	R517 L519 K536	R517-M534 HydrophobicContact CB-SD 4.12Å; L519-M534 HydrophobicContact CB-CE 4.07Å; L519-M534 HydrophobicContact CB-SD 4.4Å; L519-M534 HydrophobicContact CD1-CB 4.4Å; L519-M534 HydrophobicContact CD1-CE 3.88Å; L519-M534 HydrophobicContact CG-CE 4.39Å; M534-K536 PolarHBondContact O-N 2.84Å
535	L	94.2	Very high	93.1	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.2	174	-77.4	64.1	0	0	0	108.8	R517 V518 L520 L533 S537 L543 A546 V578	R517-L535 WeakPolarHBondContact CA-O 2.87Å; V518-L535 HydrophobicContact CB-CB 4.46Å; V518-L535 PolarHBondContact N-O 2.82Å; V518-L535 VanDerWaalsContact N-O 3.15Å; V518-L535 WeakPolarHBondContact O-CB 3.23Å; V518-L535 PolarHBondContact O-N 2.89Å; L520-L535 HydrophobicContact CD1-CD1 3.78Å; L520-L535 HydrophobicContact CD1-CD2 4.2Å; L520-L535 HydrophobicContact CG-CD1 3.96Å; L533-L535 HydrophobicContact CB-CD1 4.27Å; L535-S537 VanDerWaalsContact C-N 3.27Å; L535-S537 PolarHBondContact O-N 2.91Å; L535-L543 HydrophobicContact CD1-CD1 4.2Å; L535-L543 HydrophobicContact CD2-CB 3.97Å; L535-L543 HydrophobicContact CD2-CD1 4.14Å; L535-A546 HydrophobicContact CD1-CB 4.17Å; L535-V578 HydrophobicContact CD2-CG1 3.62Å
536	K	87.1	Confident	93.4	Very high	137 Å²	137	60.6 Å²	60.6	60%	0.596	32%	0.321	S	S	*	.	S	Bend	trans	-64	-35.1	176	-66.3	172.7	-175.6	157.8	0	111.6	M534 E549	M534-K536 PolarHBondContact O-N 2.84Å; K536-E549 IonicContact NZ-OE2 2.89Å
537	S	88.9	Confident	93.7	Very high	36 Å²	36	54.8 Å²	54.8	25%	0.252	29%	0.285	S	S	.	.	S	Bend	trans	-131.3	137.7	169.9	57	0	0	0	0	109.1	L535 T539	L535-S537 VanDerWaalsContact C-N 3.27Å; L535-S537 PolarHBondContact O-N 2.91Å; S537-T539 PolarHBondContact O-N 3.38Å; S537-T539 PolarHBondContact OG-OG1 3.34Å
538	P	91.1	Very high	93.8	Very high	19 Å²	19	53.6 Å²	53.6	12%	0.123	28%	0.281	C	S	.	.	S	Bend	trans	-82.7	54.7	-176.8	36.7	-34.5	0	0	0	110.7	K516 V518 V578 E579	K516-P538 VanDerWaalsContact O-CD 3.26Å; K516-P538 WeakPolarHBondContact O-CD 3.36Å; K516-P538 WeakPolarHBondContact O-CG 3.39Å; V518-P538 HydrophobicContact CG2-CB 3.91Å; P538-V578 VanDerWaalsContact C-CG1 3.5Å; P538-V578 CarbonylContact O-C 3.57Å; P538-E579 HydrophobicContact CG-CG 4.31Å; P538-E579 WeakPolarHBondContact O-CG 3.29Å; P538-E579 PolarHBondContact O-N 2.77Å
539	T	94.9	Very high	94	Very high	33 Å²	33	52.2 Å²	52.2	20%	0.202	28%	0.275	C	S	.	.	S	Bend	trans	-118.5	161	179.7	58.3	0	0	0	0	109.9	S537 K541 G542 L543 D575	S537-T539 PolarHBondContact O-N 3.38Å; S537-T539 PolarHBondContact OG-OG1 3.34Å; T539-K541 PolarHBondContact O-N 3.37Å; T539-G542 PolarHBondContact O-N 2.84Å; T539-G542 PolarHBondContact OG1-N 3.27Å; T539-L543 PolarHBondContact O-N 2.79Å; T539-D575 WeakPolarHBondContact CB-OD1 3.49Å
540	L	94.9	Very high	93.9	Very high	37 Å²	37	51.7 Å²	51.7	19%	0.194	26%	0.264	C	S	.	.	H	α-helix	trans	-55.3	-41.2	175.4	178.5	56.6	0	0	0	111.5	L543 M544 V561 M573 D575	L540-L543 PolarHBondContact O-N 2.85Å; L540-M544 HydrophobicContact CG-SD 4.47Å; L540-M544 WeakPolarHBondContact O-CG 3.29Å; L540-M544 PolarHBondContact O-N 2.82Å; L540-V561 HydrophobicContact CD1-CB 3.96Å; L540-V561 HydrophobicContact CD1-CG1 4.27Å; L540-V561 HydrophobicContact CD1-CG2 4.02Å; L540-M573 HydrophobicContact CD1-CB 3.85Å; L540-D575 VanDerWaalsContact CB-OD1 3.24Å; L540-D575 WeakPolarHBondContact CB-OD1 3.18Å; L540-D575 PolarHBondContact N-OD1 2.83Å
541	K	94.3	Very high	93.7	Very high	148 Å²	148	49.7 Å²	49.7	64%	0.643	25%	0.254	S	S	*	.	H	α-helix	trans	-62.2	-45.8	174.6	-172.6	178.1	178.2	-177.9	0	111.7	T539 L543 M544 D545	T539-K541 PolarHBondContact O-N 3.37Å; K541-L543 VanDerWaalsContact C-N 3.28Å; K541-L543 PolarHBondContact O-N 2.8Å; K541-M544 WeakPolarHBondContact O-CB 3.21Å; K541-M544 PolarHBondContact O-N 2.74Å; K541-D545 WeakPolarHBondContact O-CB 3.48Å; K541-D545 PolarHBondContact O-N 2.96Å
542	G	94.2	Very high	93.4	Very high	4 Å²	4	50.8 Å²	50.8	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-62.1	-34.9	177.5	0	0	0	0	0	113.2	T539 A546	T539-G542 PolarHBondContact O-N 2.84Å; T539-G542 PolarHBondContact OG1-N 3.27Å; G542-A546 WeakPolarHBondContact O-CB 3.37Å; G542-A546 PolarHBondContact O-N 2.85Å
543	L	95	Very high	93.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-46	172.7	178.1	62.9	0	0	0	112	L520 L535 T539 L540 K541 D545 A546 I547 V561 V578 Y581 L602	L520-L543 HydrophobicContact CD1-CD1 3.94Å; L535-L543 HydrophobicContact CD1-CD1 4.2Å; L535-L543 HydrophobicContact CD2-CB 3.97Å; L535-L543 HydrophobicContact CD2-CD1 4.14Å; T539-L543 PolarHBondContact O-N 2.79Å; L540-L543 PolarHBondContact O-N 2.85Å; K541-L543 VanDerWaalsContact C-N 3.28Å; K541-L543 PolarHBondContact O-N 2.8Å; L543-D545 VanDerWaalsContact C-N 3.34Å; L543-D545 PolarHBondContact O-N 3.01Å; L543-A546 PolarHBondContact O-N 3.11Å; L543-I547 HydrophobicContact CD1-CD1 3.97Å; L543-I547 HydrophobicContact CD1-CG1 4.34Å; L543-I547 HydrophobicContact CG-CD1 4.03Å; L543-I547 VanDerWaalsContact O-CG1 3.31Å; L543-I547 WeakPolarHBondContact O-CG1 3.5Å; L543-I547 PolarHBondContact O-N 2.94Å; L543-V561 HydrophobicContact CD2-CG1 4.29Å; L543-V578 HydrophobicContact CB-CG1 4.35Å; L543-V578 HydrophobicContact CD2-CG2 3.98Å; L543-Y581 HydrophobicContact CD2-CE2 4.38Å; L543-L602 HydrophobicContact CD1-CD1 4.19Å; L543-L602 HydrophobicContact CD2-CD1 3.85Å
544	M	94.9	Very high	93	Very high	33 Å²	33	50.8 Å²	50.8	16%	0.163	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-44.6	175.5	-73.7	175.8	156.7	0	0	111.5	L540 K541 I547 S548 T555 I558 V561	L540-M544 HydrophobicContact CG-SD 4.47Å; L540-M544 WeakPolarHBondContact O-CG 3.29Å; L540-M544 PolarHBondContact O-N 2.82Å; K541-M544 WeakPolarHBondContact O-CB 3.21Å; K541-M544 PolarHBondContact O-N 2.74Å; M544-I547 PolarHBondContact O-N 2.86Å; M544-S548 VanDerWaalsContact O-CB 3.29Å; M544-S548 WeakPolarHBondContact O-CB 3.24Å; M544-S548 PolarHBondContact O-N 2.95Å; M544-T555 HydrophobicContact CB-CG2 4.2Å; M544-I558 HydrophobicContact CB-CD1 4.25Å; M544-I558 HydrophobicContact CE-CB 4.09Å; M544-I558 HydrophobicContact CE-CG2 3.75Å; M544-I558 WeakPolarHBondContact CE-O 3.43Å; M544-I558 HydrophobicContact CG-CD1 4.34Å; M544-I558 HydrophobicContact CG-CG2 4.39Å; M544-V561 HydrophobicContact CE-CG2 3.53Å; M544-V561 HydrophobicContact CG-CG2 4.08Å
545	D	95.3	Very high	92.8	Very high	69 Å²	69	48 Å²	48	37%	0.369	26%	0.259	S	S	.	.	H	α-helix	trans	-60.9	-45.2	177.8	-68.2	-21.7	0	0	0	111	K541 L543 S548 E549 T555	K541-D545 WeakPolarHBondContact O-CB 3.48Å; K541-D545 PolarHBondContact O-N 2.96Å; L543-D545 VanDerWaalsContact C-N 3.34Å; L543-D545 PolarHBondContact O-N 3.01Å; D545-S548 WeakPolarHBondContact O-CB 3.41Å; D545-S548 PolarHBondContact O-N 2.83Å; D545-E549 WeakPolarHBondContact O-CB 3.41Å; D545-E549 PolarHBondContact O-N 3.26Å; D545-T555 WeakPolarHBondContact OD1-CG2 3.42Å
546	A	95.1	Very high	92.7	Very high	10 Å²	10	55.7 Å²	55.7	8%	0.083	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-40.9	178.2	0	0	0	0	0	112.6	L535 G542 L543 S548 K550	L535-A546 HydrophobicContact CD1-CB 4.17Å; G542-A546 WeakPolarHBondContact O-CB 3.37Å; G542-A546 PolarHBondContact O-N 2.85Å; L543-A546 PolarHBondContact O-N 3.11Å; A546-S548 VanDerWaalsContact C-N 3.32Å; A546-K550 WeakPolarHBondContact O-CB 3.44Å; A546-K550 PolarHBondContact O-N 3.35Å; A546-K550 VanDerWaalsContact O-N 3.08Å
547	I	94.2	Very high	92.9	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66.1	-39	175.2	-69	173.1	0	0	0	110.4	L533 L543 M544 Y551 L589 V600	L533-I547 HydrophobicContact CD1-CG1 3.86Å; L543-I547 HydrophobicContact CD1-CD1 3.97Å; L543-I547 HydrophobicContact CD1-CG1 4.34Å; L543-I547 HydrophobicContact CG-CD1 4.03Å; L543-I547 VanDerWaalsContact O-CG1 3.31Å; L543-I547 WeakPolarHBondContact O-CG1 3.5Å; L543-I547 PolarHBondContact O-N 2.94Å; M544-I547 PolarHBondContact O-N 2.86Å; I547-Y551 HydrophobicContact CG2-CD2 4.14Å; I547-Y551 WeakPolarHBondContact O-CB 3.36Å; I547-Y551 PolarHBondContact O-N 2.96Å; I547-L589 HydrophobicContact CD1-CD1 4.47Å; I547-V600 HydrophobicContact CD1-CG1 3.9Å
548	S	94.3	Very high	93.1	Very high	29 Å²	29	52.3 Å²	52.3	20%	0.203	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-49.2	176.7	-169.6	0	0	0	0	111.9	M544 D545 A546 K550 G552 V553 T555	M544-S548 VanDerWaalsContact O-CB 3.29Å; M544-S548 WeakPolarHBondContact O-CB 3.24Å; M544-S548 PolarHBondContact O-N 2.95Å; D545-S548 WeakPolarHBondContact O-CB 3.41Å; D545-S548 PolarHBondContact O-N 2.83Å; A546-S548 VanDerWaalsContact C-N 3.32Å; S548-K550 VanDerWaalsContact C-N 3.32Å; S548-K550 PolarHBondContact O-N 2.97Å; S548-G552 VanDerWaalsContact O-CA 3.31Å; S548-G552 WeakPolarHBondContact O-CA 3.48Å; S548-G552 PolarHBondContact O-N 3.38Å; S548-V553 WeakPolarHBondContact CA-O 3.14Å; S548-V553 WeakPolarHBondContact CB-O 3.37Å; S548-V553 PolarHBondContact OG-O 3.24Å; S548-T555 VanDerWaalsContact CB-CG2 3.49Å
549	E	93.7	Very high	93	Very high	153 Å²	153	54.7 Å²	54.7	72%	0.715	29%	0.294	S	S	*	.	H	α-helix	trans	-60.3	-41.4	179	-173.2	175.7	166.5	0	0	111.6	K536 D545	K536-E549 IonicContact NZ-OE2 2.89Å; D545-E549 WeakPolarHBondContact O-CB 3.41Å; D545-E549 PolarHBondContact O-N 3.26Å
550	K	93.1	Very high	92.9	Very high	96 Å²	96	58.3 Å²	58.3	42%	0.417	31%	0.307	S	S	.	.	H	α-helix	trans	-82.7	-40.5	-175.7	-170.6	74.7	-167.8	-141.8	0	114	D531 L533 A546 S548	D531-K550 HydrophobicContact CB-CD 4.5Å; D531-K550 HydrophobicContact CB-CG 4.49Å; D531-K550 WeakPolarHBondContact OD1-CE 3.38Å; D531-K550 IonicContact OD1-NZ 3.85Å; D531-K550 PolarHBondContact OD1-NZ 3.16Å; L533-K550 HydrophobicContact CD2-CB 3.49Å; L533-K550 VanDerWaalsContact CD2-CB 3.49Å; L533-K550 HydrophobicContact CD2-CD 4.46Å; L533-K550 HydrophobicContact CD2-CG 3.72Å; A546-K550 WeakPolarHBondContact O-CB 3.44Å; A546-K550 PolarHBondContact O-N 3.35Å; A546-K550 VanDerWaalsContact O-N 3.08Å; S548-K550 VanDerWaalsContact C-N 3.32Å; S548-K550 PolarHBondContact O-N 2.97Å
551	Y	91.8	Very high	93	Very high	42 Å²	42	56.8 Å²	56.8	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-112.4	1.8	-169.9	-61.4	-74.3	0	0	0	114.1	V522 D531 L533 I547 V553 L589 I591	V522-Y551 PolarHBondContact O-OH 2.86Å; D531-Y551 WeakPolarHBondContact CB-OH 3.44Å; D531-Y551 WeakPolarHBondContact OD2-CE1 3.39Å; D531-Y551 PolarHBondContact OD2-OH 3.17Å; L533-Y551 HydrophobicContact CD1-CE2 4.33Å; L533-Y551 HydrophobicContact CD2-CE2 4.06Å; I547-Y551 HydrophobicContact CG2-CD2 4.14Å; I547-Y551 WeakPolarHBondContact O-CB 3.36Å; I547-Y551 PolarHBondContact O-N 2.96Å; Y551-V553 VanDerWaalsContact C-N 3.29Å; Y551-V553 PolarHBondContact O-N 2.89Å; Y551-L589 HydrophobicContact CD1-CD2 4.35Å; Y551-L589 HydrophobicContact CD2-CD2 3.6Å; Y551-L589 HydrophobicContact CE1-CD2 4.14Å; Y551-L589 HydrophobicContact CE2-CD2 3.32Å; Y551-L589 HydrophobicContact CG-CD2 4.1Å; Y551-I591 HydrophobicContact CG-CD1 4.46Å
552	G	89.7	Confident	93.1	Very high	63 Å²	63	51.8 Å²	51.8	65%	0.649	28%	0.277	S	S	*	.			trans	70	22.9	175.4	0	0	0	0	0	114.3	S548 P554	S548-G552 VanDerWaalsContact O-CA 3.31Å; S548-G552 WeakPolarHBondContact O-CA 3.48Å; S548-G552 PolarHBondContact O-N 3.38Å; G552-P554 WeakPolarHBondContact O-CD 3.5Å
553	V	90.4	Very high	93.2	Very high	8 Å²	8	53.6 Å²	53.6	5%	0.048	28%	0.284	C	S	.	.			trans	-91.6	114.1	178.3	-175.7	0	0	0	0	108.9	S548 Y551 T555 I558 I591 F598	S548-V553 WeakPolarHBondContact CA-O 3.14Å; S548-V553 WeakPolarHBondContact CB-O 3.37Å; S548-V553 PolarHBondContact OG-O 3.24Å; Y551-V553 VanDerWaalsContact C-N 3.29Å; Y551-V553 PolarHBondContact O-N 2.89Å; V553-T555 PolarHBondContact O-N 2.71Å; V553-I558 HydrophobicContact CB-CD1 4.45Å; V553-I558 HydrophobicContact CG1-CD1 4Å; V553-I558 HydrophobicContact CG1-CG1 3.61Å; V553-I591 HydrophobicContact CG2-CD1 3.94Å; V553-I591 HydrophobicContact CG2-CG2 4.29Å; V553-F598 HydrophobicContact CG1-CB 3.86Å; V553-F598 HydrophobicContact CG1-CD1 4.23Å; V553-F598 HydrophobicContact CG1-CD2 3.37Å; V553-F598 HydrophobicContact CG1-CE2 3.9Å; V553-F598 HydrophobicContact CG1-CG 3.55Å
554	P	91.2	Very high	93.2	Very high	48 Å²	48	57.7 Å²	57.7	31%	0.312	30%	0.301	S	S	.	.			trans	-60.8	131.4	-179	-22.5	33.5	0	0	0	111.2	G552 E556 R557 I558	G552-P554 WeakPolarHBondContact O-CD 3.5Å; P554-E556 WeakPolarHBondContact CB-OE2 3.42Å; P554-E556 PolarHBondContact O-N 3.35Å; P554-R557 HydrophobicContact CB-CB 4.4Å; P554-R557 HydrophobicContact CB-CG 4.17Å; P554-R557 PolarHBondContact O-N 3.2Å; P554-I558 PolarHBondContact O-N 3.26Å
555	T	90.7	Very high	93	Very high	39 Å²	39	57.3 Å²	57.3	24%	0.239	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-61.5	-31.9	-176.4	50.6	0	0	0	0	112.4	M544 D545 S548 V553 R557 I558	M544-T555 HydrophobicContact CB-CG2 4.2Å; D545-T555 WeakPolarHBondContact OD1-CG2 3.42Å; S548-T555 VanDerWaalsContact CB-CG2 3.49Å; V553-T555 PolarHBondContact O-N 2.71Å; T555-R557 PolarHBondContact O-N 3.36Å; T555-I558 PolarHBondContact O-N 3.35Å; T555-I558 VanDerWaalsContact O-N 3.16Å
556	E	91.3	Very high	92.7	Very high	164 Å²	164	60.4 Å²	60.4	77%	0.766	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-67	-21.9	177	-45.7	88.6	177.4	0	0	112.5	P554	P554-E556 WeakPolarHBondContact CB-OE2 3.42Å; P554-E556 PolarHBondContact O-N 3.35Å
557	R	92.6	Very high	92.4	Very high	93 Å²	93	69 Å²	69	35%	0.351	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-92.8	-10.7	178.4	-62.1	-173.6	68.3	-172.3	5.3	112.5	P554 T555 A559 D596 A597 F598	P554-R557 HydrophobicContact CB-CB 4.4Å; P554-R557 HydrophobicContact CB-CG 4.17Å; P554-R557 PolarHBondContact O-N 3.2Å; T555-R557 PolarHBondContact O-N 3.36Å; R557-A559 PolarHBondContact O-N 2.91Å; R557-D596 PolarHBondContact NE-O 2.82Å; R557-D596 PolarHBondContact NH2-O 2.89Å; R557-D596 IonicContact NH2-OD1 2.98Å; R557-A597 CarbonylContact O-C 3.48Å; R557-A597 VanDerWaalsContact O-CA 3.26Å; R557-A597 WeakPolarHBondContact O-CA 3.37Å; R557-A597 WeakPolarHBondContact O-CB 3.48Å; R557-F598 HydrophobicContact CB-CD2 3.64Å; R557-F598 HydrophobicContact CB-CE2 3.95Å; R557-F598 PolarHBondContact O-N 2.78Å
558	I	92.9	Very high	92.2	Very high	8 Å²	8	71 Å²	71	4%	0.041	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	91.4	176.2	-53.9	175.2	0	0	0	108.8	M544 V553 P554 T555 V561 V600	M544-I558 HydrophobicContact CB-CD1 4.25Å; M544-I558 HydrophobicContact CE-CB 4.09Å; M544-I558 HydrophobicContact CE-CG2 3.75Å; M544-I558 WeakPolarHBondContact CE-O 3.43Å; M544-I558 HydrophobicContact CG-CD1 4.34Å; M544-I558 HydrophobicContact CG-CG2 4.39Å; V553-I558 HydrophobicContact CB-CD1 4.45Å; V553-I558 HydrophobicContact CG1-CD1 4Å; V553-I558 HydrophobicContact CG1-CG1 3.61Å; P554-I558 PolarHBondContact O-N 3.26Å; T555-I558 PolarHBondContact O-N 3.35Å; T555-I558 VanDerWaalsContact O-N 3.16Å; I558-V561 HydrophobicContact CG2-CG2 3.67Å; I558-V600 HydrophobicContact CG2-CB 4.44Å; I558-V600 HydrophobicContact CG2-CG2 3.77Å
559	A	89.3	Confident	92.1	Very high	69 Å²	69	74.5 Å²	74.5	57%	0.57	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	-33.1	-176.6	0	0	0	0	0	112.9	R557 A597 F598	R557-A559 PolarHBondContact O-N 2.91Å; A559-A597 HydrophobicContact CB-CB 3.63Å; A559-F598 PolarHBondContact N-O 3.26Å
560	K	92.3	Very high	92.2	Very high	109 Å²	109	71.1 Å²	71.1	47%	0.474	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	136.3	-176.3	-55.7	-167.3	-171.2	178	0	111.4	Y562 K599 V600	K560-Y562 HydrophobicContact CB-CD2 4.28Å; K560-Y562 HydrophobicContact CB-CE2 3.57Å; K560-Y562 HydrophobicContact CD-CE2 4.01Å; K560-Y562 WeakPolarHBondContact CD-OH 3.08Å; K560-Y562 HydrophobicContact CG-CE2 4.43Å; K560-K599 WeakPolarHBondContact O-CA 3.45Å; K560-V600 PolarHBondContact O-N 3.41Å
561	V	96.1	Very high	92.2	Very high	5 Å²	5	69.2 Å²	69.2	3%	0.03	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.2	173.2	-174.3	0	0	0	0	107.4	L540 L543 M544 I558 N572 M573 V600	L540-V561 HydrophobicContact CD1-CB 3.96Å; L540-V561 HydrophobicContact CD1-CG1 4.27Å; L540-V561 HydrophobicContact CD1-CG2 4.02Å; L543-V561 HydrophobicContact CD2-CG1 4.29Å; M544-V561 HydrophobicContact CE-CG2 3.53Å; M544-V561 HydrophobicContact CG-CG2 4.08Å; I558-V561 HydrophobicContact CG2-CG2 3.67Å; V561-N572 PolarHBondContact O-OD1 3.08Å; V561-M573 HydrophobicContact CB-CB 3.94Å; V561-M573 HydrophobicContact CB-CG 4.49Å; V561-M573 HydrophobicContact CG1-CB 3.92Å; V561-M573 HydrophobicContact CG1-CG 3.93Å; V561-M573 WeakPolarHBondContact O-CB 3.4Å; V561-M573 PolarHBondContact O-N 3.06Å; V561-V600 CarbonylContact C-O 3.54Å; V561-V600 WeakPolarHBondContact CA-O 3.3Å; V561-V600 HydrophobicContact CG1-CB 4.31Å; V561-V600 HydrophobicContact CG1-CG1 4.16Å; V561-V600 HydrophobicContact CG2-CB 4.25Å
562	Y	96.9	Very high	92.4	Very high	43 Å²	43	72.2 Å²	72.2	17%	0.169	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.4	-179.1	-64.5	-73.4	0	0	0	111	K560 L570 V571 N572 K599 V600 I601 L602	K560-Y562 HydrophobicContact CB-CD2 4.28Å; K560-Y562 HydrophobicContact CB-CE2 3.57Å; K560-Y562 HydrophobicContact CD-CE2 4.01Å; K560-Y562 WeakPolarHBondContact CD-OH 3.08Å; K560-Y562 HydrophobicContact CG-CE2 4.43Å; Y562-L570 HydrophobicContact CD1-CD2 4.14Å; Y562-L570 HydrophobicContact CD1-CG 4.11Å; Y562-L570 HydrophobicContact CD2-CD2 4.41Å; Y562-L570 HydrophobicContact CG-CD1 4.34Å; Y562-L570 HydrophobicContact CG-CD2 4.05Å; Y562-L570 HydrophobicContact CG-CG 4.07Å; Y562-V571 CarbonylContact C-O 3.57Å; Y562-V571 VanDerWaalsContact CA-O 3.24Å; Y562-V571 WeakPolarHBondContact CA-O 3.42Å; Y562-N572 HydrophobicContact CD1-CB 4.37Å; Y562-N572 HydrophobicContact CE1-CB 4.23Å; Y562-K599 HydrophobicContact CD2-CD 4.12Å; Y562-K599 HydrophobicContact CD2-CG 3.85Å; Y562-K599 HydrophobicContact CE2-CD 3.81Å; Y562-K599 HydrophobicContact CE2-CG 3.82Å; Y562-V600 PolarHBondContact N-O 2.8Å; Y562-I601 CarbonylContact O-C 3.51Å; Y562-I601 WeakPolarHBondContact O-CA 3.4Å; Y562-L602 PolarHBondContact O-N 3.01Å
563	K	96.1	Very high	92.6	Very high	43 Å²	43	69.6 Å²	69.6	19%	0.187	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.1	164.1	-176.6	-171.1	176.4	-167	0	109.1	L570 V571 M573 I577 L602 E604	K563-L570 CarbonylContact O-C 3.56Å; K563-L570 WeakPolarHBondContact O-CA 3.45Å; K563-V571 HydrophobicContact CB-CB 4.46Å; K563-V571 PolarHBondContact N-O 3.47Å; K563-V571 PolarHBondContact O-N 3.2Å; K563-M573 HydrophobicContact CB-CE 3.73Å; K563-M573 HydrophobicContact CD-CE 4.25Å; K563-M573 HydrophobicContact CG-CE 4.32Å; K563-I577 HydrophobicContact CD-CG2 4.37Å; K563-L602 CarbonylContact C-O 3.5Å; K563-L602 WeakPolarHBondContact CA-O 3.39Å; K563-E604 WeakPolarHBondContact CE-OE2 3.42Å; K563-E604 IonicContact NZ-OE2 2.76Å; K563-E604 PolarHBondContact NZ-OE2 2.78Å
564	K	95.6	Very high	92.8	Very high	86 Å²	86	72.2 Å²	72.2	37%	0.374	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.5	167.6	-171.6	178.8	179.6	-175.9	0	108.7	I569 L570 I601 L602 T603 E604	K564-I569 WeakPolarHBondContact CA-O 3.48Å; K564-L570 HydrophobicContact CB-CD1 3.94Å; K564-L570 HydrophobicContact CG-CD1 4.43Å; K564-I601 HydrophobicContact CB-CG2 4.03Å; K564-L602 PolarHBondContact N-O 3.03Å; K564-T603 HydrophobicContact CB-CG2 4.16Å; K564-T603 HydrophobicContact CD-CG2 4.02Å; K564-T603 HydrophobicContact CG-CG2 4.23Å; K564-T603 WeakPolarHBondContact O-CA 3.3Å; K564-E604 PolarHBondContact O-N 3.3Å
565	S	91.5	Very high	92.9	Very high	25 Å²	25	73.6 Å²	73.6	18%	0.175	38%	0.375	C	S	.	.			trans	-70.5	164.4	177	65.8	0	0	0	0	111.9	K567 G568 I569	S565-K567 PolarHBondContact O-N 2.66Å; S565-K567 VanDerWaalsContact O-N 3.07Å; S565-G568 WeakPolarHBondContact O-CA 3.44Å; S565-G568 PolarHBondContact O-N 2.8Å; S565-I569 PolarHBondContact N-O 2.88Å; S565-I569 WeakPolarHBondContact OG-CB 3.15Å; S565-I569 PolarHBondContact OG-N 2.85Å; S565-I569 PolarHBondContact OG-O 2.83Å
566	K	88.9	Confident	92.8	Very high	134 Å²	134	76.5 Å²	76.5	58%	0.583	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.6	172.9	-55.3	-168.9	-174.1	-146.2	0	113.7	G568 E604 I605	K566-G568 PolarHBondContact O-N 2.82Å; K566-E604 HydrophobicContact CG-CB 4.29Å; K566-E604 HydrophobicContact CG-CG 4.19Å; K566-I605 WeakPolarHBondContact CE-O 3.28Å; K566-I605 VanDerWaalsContact CE-OXT 3.27Å; K566-I605 WeakPolarHBondContact CE-OXT 3.02Å; K566-I605 PolarHBondContact NZ-O 3.21Å; K566-I605 PolarHBondContact NZ-OXT 2.92Å
567	K	88.9	Confident	92.9	Very high	190 Å²	190	70.8 Å²	70.8	83%	0.826	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	3.2	175.7	-63.3	-174.9	179.2	-179.4	0	113.5	S565 I569	S565-K567 PolarHBondContact O-N 2.66Å; S565-K567 VanDerWaalsContact O-N 3.07Å; K567-I569 VanDerWaalsContact C-N 3.29Å; K567-I569 HydrophobicContact CB-CD1 4.48Å; K567-I569 HydrophobicContact CB-CG1 4.4Å; K567-I569 PolarHBondContact O-N 2.85Å
568	G	88.8	Confident	92.9	Very high	43 Å²	43	66.3 Å²	66.3	44%	0.443	35%	0.347	S	S	.	.	S	Bend	trans	80.5	0.6	-178.7	0	0	0	0	0	115.2	S565 K566 L570	S565-G568 WeakPolarHBondContact O-CA 3.44Å; S565-G568 PolarHBondContact O-N 2.8Å; K566-G568 PolarHBondContact O-N 2.82Å; G568-L570 PolarHBondContact O-N 3.42Å
569	I	93.4	Very high	92.8	Very high	103 Å²	103	70.5 Å²	70.5	53%	0.528	37%	0.366	S	S	.	.			trans	-72.7	128.1	178.9	-55.2	173.4	0	0	0	109.5	K564 S565 K567 V571	K564-I569 WeakPolarHBondContact CA-O 3.48Å; S565-I569 PolarHBondContact N-O 2.88Å; S565-I569 WeakPolarHBondContact OG-CB 3.15Å; S565-I569 PolarHBondContact OG-N 2.85Å; S565-I569 PolarHBondContact OG-O 2.83Å; K567-I569 VanDerWaalsContact C-N 3.29Å; K567-I569 HydrophobicContact CB-CD1 4.48Å; K567-I569 HydrophobicContact CB-CG1 4.4Å; K567-I569 PolarHBondContact O-N 2.85Å; I569-V571 HydrophobicContact CG2-CG2 4.2Å
570	L	94.1	Very high	92.8	Very high	83 Å²	83	74.1 Å²	74.1	44%	0.435	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126	175.6	-160.1	73.6	0	0	0	110.2	Y562 K563 K564 G568 I601	Y562-L570 HydrophobicContact CD1-CD2 4.14Å; Y562-L570 HydrophobicContact CD1-CG 4.11Å; Y562-L570 HydrophobicContact CD2-CD2 4.41Å; Y562-L570 HydrophobicContact CG-CD1 4.34Å; Y562-L570 HydrophobicContact CG-CD2 4.05Å; Y562-L570 HydrophobicContact CG-CG 4.07Å; K563-L570 CarbonylContact O-C 3.56Å; K563-L570 WeakPolarHBondContact O-CA 3.45Å; K564-L570 HydrophobicContact CB-CD1 3.94Å; K564-L570 HydrophobicContact CG-CD1 4.43Å; G568-L570 PolarHBondContact O-N 3.42Å; L570-I601 HydrophobicContact CD1-CG2 3.94Å
571	V	94.7	Very high	92.7	Very high	56 Å²	56	69.5 Å²	69.5	34%	0.339	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.2	-175.6	-176.2	0	0	0	0	108.8	Y562 K563 I569 I577	Y562-V571 CarbonylContact C-O 3.57Å; Y562-V571 VanDerWaalsContact CA-O 3.24Å; Y562-V571 WeakPolarHBondContact CA-O 3.42Å; K563-V571 HydrophobicContact CB-CB 4.46Å; K563-V571 PolarHBondContact N-O 3.47Å; K563-V571 PolarHBondContact O-N 3.2Å; I569-V571 HydrophobicContact CG2-CG2 4.2Å; V571-I577 HydrophobicContact CG1-CD1 3.83Å
572	N	95.1	Very high	92.4	Very high	105 Å²	105	70.6 Å²	70.6	56%	0.561	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.7	174	-164.7	25.6	0	0	0	109.8	V561 Y562 I577	V561-N572 PolarHBondContact O-OD1 3.08Å; Y562-N572 HydrophobicContact CD1-CB 4.37Å; Y562-N572 HydrophobicContact CE1-CB 4.23Å; N572-I577 VanDerWaalsContact O-CD1 3.3Å; N572-I577 WeakPolarHBondContact O-CD1 3.47Å
573	M	94.3	Very high	92.1	Very high	7 Å²	7	72.7 Å²	72.7	3%	0.034	37%	0.372	C	S	.	.			trans	-77.4	141.4	-178.5	-97.8	-76.1	165.5	0	0	112.3	L540 V561 K563 I577 V578 Y581	L540-M573 HydrophobicContact CD1-CB 3.85Å; V561-M573 HydrophobicContact CB-CB 3.94Å; V561-M573 HydrophobicContact CB-CG 4.49Å; V561-M573 HydrophobicContact CG1-CB 3.92Å; V561-M573 HydrophobicContact CG1-CG 3.93Å; V561-M573 WeakPolarHBondContact O-CB 3.4Å; V561-M573 PolarHBondContact O-N 3.06Å; K563-M573 HydrophobicContact CB-CE 3.73Å; K563-M573 HydrophobicContact CD-CE 4.25Å; K563-M573 HydrophobicContact CG-CE 4.32Å; M573-I577 HydrophobicContact CE-CB 3.9Å; M573-I577 HydrophobicContact CE-CG2 3.23Å; M573-I577 HydrophobicContact SD-CB 3.78Å; M573-I577 HydrophobicContact SD-CG2 3.84Å; M573-V578 HydrophobicContact SD-CG2 3.5Å; M573-V578 WeakPolarHBondContact SD-CG2 3.3Å; M573-Y581 HydrophobicContact CE-CE1 4.11Å; M573-Y581 HydrophobicContact CE-CE2 3.66Å; M573-Y581 WeakPolarHBondContact CE-OH 3.26Å; M573-Y581 HydrophobicContact SD-CE2 4.49Å
574	D	93.8	Very high	91.9	Very high	63 Å²	63	76.2 Å²	76.2	34%	0.337	39%	0.389	S	S	.	.			trans	-140.1	174	171	73.9	-10.8	0	0	0	110	N576 I577 V578	D574-N576 VanDerWaalsContact C-N 3.26Å; D574-N576 PolarHBondContact O-N 3.44Å; D574-N576 PolarHBondContact OD1-N 3.07Å; D574-N576 PolarHBondContact OD2-ND2 2.97Å; D574-I577 PolarHBondContact O-N 3.31Å; D574-I577 WeakPolarHBondContact OD1-CD1 3.46Å; D574-I577 WeakPolarHBondContact OD1-CG1 3.3Å; D574-I577 PolarHBondContact OD1-N 2.89Å; D574-V578 WeakPolarHBondContact O-CG2 3.26Å; D574-V578 PolarHBondContact O-N 2.65Å
575	D	92.9	Very high	91.9	Very high	78 Å²	78	74.1 Å²	74.1	42%	0.417	38%	0.382	S	S	.	.	H	α-helix	trans	-59.2	-39.2	-179.5	-70.2	-17.2	0	0	0	111.8	T539 L540 I577 V578 E579	T539-D575 WeakPolarHBondContact CB-OD1 3.49Å; L540-D575 VanDerWaalsContact CB-OD1 3.24Å; L540-D575 WeakPolarHBondContact CB-OD1 3.18Å; L540-D575 PolarHBondContact N-OD1 2.83Å; D575-I577 VanDerWaalsContact C-N 3.34Å; D575-I577 PolarHBondContact O-N 2.82Å; D575-V578 PolarHBondContact O-N 2.89Å; D575-E579 WeakPolarHBondContact O-CG 3.18Å; D575-E579 PolarHBondContact O-N 2.73Å
576	N	90.5	Very high	92.1	Very high	99 Å²	99	75.2 Å²	75.2	53%	0.529	39%	0.388	S	S	.	.	H	α-helix	trans	-58	-46.6	178.9	-61.1	-61.5	0	0	0	111	D574 V578 E579 H580	D574-N576 VanDerWaalsContact C-N 3.26Å; D574-N576 PolarHBondContact O-N 3.44Å; D574-N576 PolarHBondContact OD1-N 3.07Å; D574-N576 PolarHBondContact OD2-ND2 2.97Å; N576-V578 VanDerWaalsContact C-N 3.34Å; N576-V578 PolarHBondContact O-N 2.91Å; N576-E579 PolarHBondContact O-N 3.38Å; N576-H580 PolarHBondContact O-N 2.62Å; N576-H580 PolarHBondContact O-ND1 3.2Å
577	I	92.4	Very high	92.4	Very high	44 Å²	44	69 Å²	69	23%	0.226	36%	0.361	C	S	.	.	H	α-helix	trans	-67.5	-37.9	-178.4	-58.5	157.7	0	0	0	110.8	K563 V571 N572 M573 D574 D575 H580	K563-I577 HydrophobicContact CD-CG2 4.37Å; V571-I577 HydrophobicContact CG1-CD1 3.83Å; N572-I577 VanDerWaalsContact O-CD1 3.3Å; N572-I577 WeakPolarHBondContact O-CD1 3.47Å; M573-I577 HydrophobicContact CE-CB 3.9Å; M573-I577 HydrophobicContact CE-CG2 3.23Å; M573-I577 HydrophobicContact SD-CB 3.78Å; M573-I577 HydrophobicContact SD-CG2 3.84Å; D574-I577 PolarHBondContact O-N 3.31Å; D574-I577 WeakPolarHBondContact OD1-CD1 3.46Å; D574-I577 WeakPolarHBondContact OD1-CG1 3.3Å; D574-I577 PolarHBondContact OD1-N 2.89Å; D575-I577 VanDerWaalsContact C-N 3.34Å; D575-I577 PolarHBondContact O-N 2.82Å; I577-H580 PolarHBondContact O-N 2.89Å
578	V	92.4	Very high	92.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67.2	-36.6	178.1	-176.4	0	0	0	0	111.8	L535 P538 L543 M573 D574 D575 N576 H580 Y581	L535-V578 HydrophobicContact CD2-CG1 3.62Å; P538-V578 VanDerWaalsContact C-CG1 3.5Å; P538-V578 CarbonylContact O-C 3.57Å; L543-V578 HydrophobicContact CB-CG1 4.35Å; L543-V578 HydrophobicContact CD2-CG2 3.98Å; M573-V578 HydrophobicContact SD-CG2 3.5Å; M573-V578 WeakPolarHBondContact SD-CG2 3.3Å; D574-V578 WeakPolarHBondContact O-CG2 3.26Å; D574-V578 PolarHBondContact O-N 2.65Å; D575-V578 PolarHBondContact O-N 2.89Å; N576-V578 VanDerWaalsContact C-N 3.34Å; N576-V578 PolarHBondContact O-N 2.91Å; V578-H580 PolarHBondContact O-N 2.87Å; V578-Y581 HydrophobicContact CB-CD2 4.28Å; V578-Y581 HydrophobicContact CG1-CD2 3.98Å; V578-Y581 HydrophobicContact CG1-CE2 4.48Å; V578-Y581 HydrophobicContact CG2-CE2 4.29Å; V578-Y581 WeakPolarHBondContact O-CB 3.16Å; V578-Y581 PolarHBondContact O-N 3.2Å
579	E	90.3	Very high	93.2	Very high	96 Å²	96	59.7 Å²	59.7	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-24.1	175.9	-77.1	-174	174.8	0	0	113.9	P538 D575 N576	P538-E579 HydrophobicContact CG-CG 4.31Å; P538-E579 WeakPolarHBondContact O-CG 3.29Å; P538-E579 PolarHBondContact O-N 2.77Å; D575-E579 WeakPolarHBondContact O-CG 3.18Å; D575-E579 PolarHBondContact O-N 2.73Å; N576-E579 PolarHBondContact O-N 3.38Å
580	H	88.9	Confident	93.2	Very high	145 Å²	145	56.1 Å²	56.1	67%	0.671	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.5	178	-70	72.8	0	0	0	113.2	N576 I577 V578 S582	N576-H580 PolarHBondContact O-N 2.62Å; N576-H580 PolarHBondContact O-ND1 3.2Å; I577-H580 PolarHBondContact O-N 2.89Å; V578-H580 PolarHBondContact O-N 2.87Å; H580-S582 PolarHBondContact O-N 3.05Å
581	Y	91.4	Very high	93.2	Very high	12 Å²	12	54.8 Å²	54.8	5%	0.047	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-65.6	137	172.2	-68.7	-36.7	0	0	0	111.1	L520 L543 M573 V578 D585 F587	L520-Y581 HydrophobicContact CD1-CD2 4.02Å; L520-Y581 HydrophobicContact CD1-CE2 4.33Å; L520-Y581 HydrophobicContact CD2-CD2 4.38Å; L520-Y581 HydrophobicContact CD2-CG 4.25Å; L543-Y581 HydrophobicContact CD2-CE2 4.38Å; M573-Y581 HydrophobicContact CE-CE1 4.11Å; M573-Y581 HydrophobicContact CE-CE2 3.66Å; M573-Y581 WeakPolarHBondContact CE-OH 3.26Å; M573-Y581 HydrophobicContact SD-CE2 4.49Å; V578-Y581 HydrophobicContact CB-CD2 4.28Å; V578-Y581 HydrophobicContact CG1-CD2 3.98Å; V578-Y581 HydrophobicContact CG1-CE2 4.48Å; V578-Y581 HydrophobicContact CG2-CE2 4.29Å; V578-Y581 WeakPolarHBondContact O-CB 3.16Å; V578-Y581 PolarHBondContact O-N 3.2Å; Y581-D585 WeakPolarHBondContact CA-OD2 3.44Å; Y581-F587 HydrophobicContact CD1-CE2 4.35Å; Y581-F587 AromaticContact CD1-CZ 3.81Å; Y581-F587 HydrophobicContact CD1-CZ 3.81Å; Y581-F587 AromaticContact CE1-CE1 3.95Å; Y581-F587 HydrophobicContact CE1-CE1 3.95Å; Y581-F587 HydrophobicContact CE1-CE2 4.07Å; Y581-F587 AromaticContact CE1-CZ 3.3Å; Y581-F587 HydrophobicContact CE1-CZ 3.3Å; Y581-F587 AromaticContact CZ-CZ 3.71Å
582	S	89.6	Confident	93.1	Very high	27 Å²	27	56.8 Å²	56.8	19%	0.189	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-100.6	158.3	177.5	-60.8	0	0	0	0	110.6	R471 H580 E584 D585	R471-S582 VanDerWaalsContact CZ-CB 3.48Å; R471-S582 VanDerWaalsContact CZ-OG 3.24Å; R471-S582 PolarHBondContact NH1-OG 2.7Å; R471-S582 PolarHBondContact NH2-OG 2.96Å; H580-S582 PolarHBondContact O-N 3.05Å; S582-E584 PolarHBondContact O-N 3.04Å; S582-D585 PolarHBondContact N-OD2 2.96Å; S582-D585 WeakPolarHBondContact O-CB 3.26Å; S582-D585 PolarHBondContact O-N 3.19Å
583	N	90.9	Very high	92.7	Very high	88 Å²	88	56 Å²	56	47%	0.471	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	136.2	170.2	-74.7	-39.8	0	0	0	109.8	V518 L519 D585	V518-N583 WeakPolarHBondContact CA-OD1 3.46Å; L519-N583 PolarHBondContact N-OD1 2.94Å; L519-N583 CarbonylContact O-C 3.55Å; L519-N583 WeakPolarHBondContact O-CA 3.5Å; N583-D585 VanDerWaalsContact C-N 3.28Å; N583-D585 PolarHBondContact O-N 3.04Å
584	E	92.2	Very high	92	Very high	116 Å²	116	59.8 Å²	59.8	54%	0.542	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	12.9	177.9	-48.4	-170.2	142.3	0	0	115	L519 Y521 S582 T586	L519-E584 PolarHBondContact O-N 3.34Å; Y521-E584 HydrophobicContact CD2-CB 3.8Å; Y521-E584 HydrophobicContact CD2-CG 4.31Å; Y521-E584 HydrophobicContact CE2-CB 3.42Å; Y521-E584 VanDerWaalsContact CE2-CB 3.42Å; Y521-E584 HydrophobicContact CE2-CG 3.48Å; Y521-E584 VanDerWaalsContact CE2-CG 3.48Å; Y521-E584 PolarHBondContact OH-OE1 2.7Å; S582-E584 PolarHBondContact O-N 3.04Å; E584-T586 PolarHBondContact O-N 3.31Å
585	D	94	Very high	90.7	Very high	43 Å²	43	61.5 Å²	61.5	23%	0.23	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	131.3	170.4	-77.7	-7.3	0	0	0	109.8	L520 Y521 Y581 S582 N583 F587	L520-D585 HydrophobicContact CD2-CB 4.07Å; Y521-D585 PolarHBondContact N-O 2.93Å; Y581-D585 WeakPolarHBondContact CA-OD2 3.44Å; S582-D585 PolarHBondContact N-OD2 2.96Å; S582-D585 WeakPolarHBondContact O-CB 3.26Å; S582-D585 PolarHBondContact O-N 3.19Å; N583-D585 VanDerWaalsContact C-N 3.28Å; N583-D585 PolarHBondContact O-N 3.04Å; D585-F587 HydrophobicContact CB-CE2 3.59Å; D585-F587 HydrophobicContact CB-CZ 3.91Å
586	T	95.9	Very high	90.2	Very high	48 Å²	48	64 Å²	64	29%	0.294	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.9	-171.7	55.1	0	0	0	0	112.1	Y521 F530 E584	Y521-T586 HydrophobicContact CD2-CG2 4.3Å; Y521-T586 CarbonylContact O-C 3.6Å; Y521-T586 VanDerWaalsContact O-CA 3.23Å; Y521-T586 WeakPolarHBondContact O-CA 3.36Å; F530-T586 HydrophobicContact CE1-CG2 4.26Å; E584-T586 PolarHBondContact O-N 3.31Å
587	F	96.9	Very high	90	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.013	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.3	179.4	-57.1	-81.5	0	0	0	112.7	L520 Y521 V522 R523 Y581 D585 L602 T603 E604	L520-F587 HydrophobicContact CD1-CE2 4.46Å; L520-F587 HydrophobicContact CD2-CE2 4.29Å; Y521-F587 PolarHBondContact O-N 3.29Å; V522-F587 WeakPolarHBondContact CA-O 3.45Å; V522-F587 HydrophobicContact CG2-CB 4.35Å; V522-F587 HydrophobicContact CG2-CD2 4.41Å; R523-F587 PolarHBondContact N-O 3.27Å; R523-F587 VanDerWaalsContact N-O 3.07Å; Y581-F587 HydrophobicContact CD1-CE2 4.35Å; Y581-F587 AromaticContact CD1-CZ 3.81Å; Y581-F587 HydrophobicContact CD1-CZ 3.81Å; Y581-F587 AromaticContact CE1-CE1 3.95Å; Y581-F587 HydrophobicContact CE1-CE1 3.95Å; Y581-F587 HydrophobicContact CE1-CE2 4.07Å; Y581-F587 AromaticContact CE1-CZ 3.3Å; Y581-F587 HydrophobicContact CE1-CZ 3.3Å; Y581-F587 AromaticContact CZ-CZ 3.71Å; D585-F587 HydrophobicContact CB-CE2 3.59Å; D585-F587 HydrophobicContact CB-CZ 3.91Å; F587-L602 HydrophobicContact CB-CB 4.15Å; F587-L602 HydrophobicContact CB-CD2 3.9Å; F587-L602 HydrophobicContact CD1-CB 3.95Å; F587-L602 HydrophobicContact CG-CB 4.08Å; F587-L602 HydrophobicContact CG-CD2 4.34Å; F587-T603 CarbonylContact C-O 3.57Å; F587-T603 VanDerWaalsContact CA-O 3.26Å; F587-T603 WeakPolarHBondContact CA-O 3.3Å; F587-E604 HydrophobicContact CD1-CB 4.31Å; F587-E604 HydrophobicContact CE1-CB 4.13Å; F587-E604 HydrophobicContact CE1-CG 4.23Å
588	I	96.7	Very high	90	Very high	31 Å²	31	60.2 Å²	60.2	16%	0.159	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124	159.2	-53.5	-61.1	0	0	0	108.6	R523 E525 T603 I605	R523-I588 HydrophobicContact CG-CD1 3.55Å; R523-I588 VanDerWaalsContact NE-CD1 3.33Å; R523-I588 CarbonylContact O-C 3.58Å; R523-I588 VanDerWaalsContact O-CA 3.28Å; R523-I588 WeakPolarHBondContact O-CA 2.98Å; E525-I588 HydrophobicContact CB-CG2 3.93Å; I588-T603 PolarHBondContact N-O 2.7Å; I588-T603 PolarHBondContact O-N 2.73Å; I588-I605 HydrophobicContact CD1-CD1 3.43Å; I588-I605 VanDerWaalsContact CD1-CD1 3.43Å; I588-I605 HydrophobicContact CD1-CG1 4.18Å; I588-I605 HydrophobicContact CG1-CD1 3.64Å; I588-I605 HydrophobicContact CG1-CG1 3.81Å
589	L	96.4	Very high	90.1	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.031	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	118.3	178.5	178.8	67	0	0	0	111.3	V522 R523 I547 Y551 I591 V600 L602	V522-L589 HydrophobicContact CG1-CB 3.38Å; V522-L589 HydrophobicContact CG1-CD2 4.01Å; V522-L589 HydrophobicContact CG1-CG 4.18Å; R523-L589 PolarHBondContact O-N 3.06Å; I547-L589 HydrophobicContact CD1-CD1 4.47Å; Y551-L589 HydrophobicContact CD1-CD2 4.35Å; Y551-L589 HydrophobicContact CD2-CD2 3.6Å; Y551-L589 HydrophobicContact CE1-CD2 4.14Å; Y551-L589 HydrophobicContact CE2-CD2 3.32Å; Y551-L589 HydrophobicContact CG-CD2 4.1Å; L589-I591 HydrophobicContact CD1-CD1 4.5Å; L589-I591 HydrophobicContact CD1-CG1 4.09Å; L589-I591 HydrophobicContact CD2-CD1 3.81Å; L589-I591 HydrophobicContact CD2-CG1 4.24Å; L589-I591 HydrophobicContact CG-CD1 4.11Å; L589-I591 HydrophobicContact CG-CG1 3.98Å; L589-V600 HydrophobicContact CD1-CG1 3.7Å; L589-L602 HydrophobicContact CB-CD2 4.49Å; L589-L602 HydrophobicContact CD1-CD2 3.8Å
590	G	94.8	Very high	90.4	Very high	29 Å²	29	58.5 Å²	58.5	30%	0.299	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.5	163.8	0	0	0	0	0	110.2	V600 I601	G590-V600 CarbonylContact O-C 3.53Å; G590-V600 WeakPolarHBondContact O-CA 3.4Å; G590-I601 PolarHBondContact N-O 3.03Å; G590-I601 PolarHBondContact O-N 3.03Å
591	I	93.6	Very high	90.7	Very high	55 Å²	55	52.6 Å²	52.6	28%	0.282	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	108.6	170.1	-62.2	161.7	0	0	0	107.1	Y551 V553 L589 F598 V600	Y551-I591 HydrophobicContact CG-CD1 4.46Å; V553-I591 HydrophobicContact CG2-CD1 3.94Å; V553-I591 HydrophobicContact CG2-CG2 4.29Å; L589-I591 HydrophobicContact CD1-CD1 4.5Å; L589-I591 HydrophobicContact CD1-CG1 4.09Å; L589-I591 HydrophobicContact CD2-CD1 3.81Å; L589-I591 HydrophobicContact CD2-CG1 4.24Å; L589-I591 HydrophobicContact CG-CD1 4.11Å; L589-I591 HydrophobicContact CG-CG1 3.98Å; I591-F598 HydrophobicContact CG2-CB 4.32Å; I591-F598 HydrophobicContact CG2-CD1 3.66Å; I591-F598 HydrophobicContact CG2-CE1 4.41Å; I591-F598 HydrophobicContact CG2-CG 4.32Å; I591-V600 HydrophobicContact CG1-CG2 4.4Å
592	E	91.8	Very high	91	Very high	98 Å²	98	52 Å²	52	46%	0.458	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.2	176.8	-67.2	172.3	-178.6	0	0	109.1	F598 K599	E592-F598 WeakPolarHBondContact O-CA 3.24Å; E592-K599 HydrophobicContact CB-CB 4.31Å; E592-K599 PolarHBondContact N-O 3.49Å; E592-K599 PolarHBondContact O-N 2.87Å; E592-K599 IonicContact OE1-NZ 3.2Å; E592-K599 WeakPolarHBondContact OE2-CD 3.28Å; E592-K599 IonicContact OE2-NZ 3.21Å; E592-K599 PolarHBondContact OE2-NZ 3.3Å
593	S	88	Confident	91.3	Very high	88 Å²	88	52.7 Å²	52.7	62%	0.615	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.4	173.4	179.3	0	0	0	0	109.9
594	S	79.2	Confident	91.4	Very high	86 Å²	86	51.5 Å²	51.5	60%	0.601	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	115.8	175.9	-175.5	0	0	0	0	111.5	D596 A597	S594-D596 PolarHBondContact O-N 2.99Å; S594-A597 PolarHBondContact N-O 2.76Å; S594-A597 PolarHBondContact O-N 3.34Å
595	A	65.9	Low	91.1	Very high	100 Å²	100	50.4 Å²	50.4	83%	0.826	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-24.8	169.4	0	0	0	0	0	119.3
596	D	81.6	Confident	91	Very high	129 Å²	129	50.8 Å²	50.8	69%	0.69	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.8	-0.3	161	-96.7	-28.9	0	0	0	113.1	R557 S594	R557-D596 PolarHBondContact NE-O 2.82Å; R557-D596 PolarHBondContact NH2-O 2.89Å; R557-D596 IonicContact NH2-OD1 2.98Å; S594-D596 PolarHBondContact O-N 2.99Å
597	A	88	Confident	90.7	Very high	31 Å²	31	50.9 Å²	50.9	26%	0.256	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	155.8	179.6	0	0	0	0	0	112.3	R557 A559 S594	R557-A597 CarbonylContact O-C 3.48Å; R557-A597 VanDerWaalsContact O-CA 3.26Å; R557-A597 WeakPolarHBondContact O-CA 3.37Å; R557-A597 WeakPolarHBondContact O-CB 3.48Å; A559-A597 HydrophobicContact CB-CB 3.63Å; S594-A597 PolarHBondContact N-O 2.76Å; S594-A597 PolarHBondContact O-N 3.34Å
598	F	91.8	Very high	90.4	Very high	34 Å²	34	53.6 Å²	53.6	15%	0.149	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137	172.4	-62.9	-79.9	0	0	0	110.4	V553 R557 A559 I591 E592	V553-F598 HydrophobicContact CG1-CB 3.86Å; V553-F598 HydrophobicContact CG1-CD1 4.23Å; V553-F598 HydrophobicContact CG1-CD2 3.37Å; V553-F598 HydrophobicContact CG1-CE2 3.9Å; V553-F598 HydrophobicContact CG1-CG 3.55Å; R557-F598 HydrophobicContact CB-CD2 3.64Å; R557-F598 HydrophobicContact CB-CE2 3.95Å; R557-F598 PolarHBondContact O-N 2.78Å; A559-F598 PolarHBondContact N-O 3.26Å; I591-F598 HydrophobicContact CG2-CB 4.32Å; I591-F598 HydrophobicContact CG2-CD1 3.66Å; I591-F598 HydrophobicContact CG2-CE1 4.41Å; I591-F598 HydrophobicContact CG2-CG 4.32Å; E592-F598 WeakPolarHBondContact O-CA 3.24Å
599	K	93.9	Very high	90	Very high	60 Å²	60	54.9 Å²	54.9	26%	0.261	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.1	167.3	172.8	178.9	162.3	-136.2	0	107.7	K560 Y562 E592 I601	K560-K599 WeakPolarHBondContact O-CA 3.45Å; Y562-K599 HydrophobicContact CD2-CD 4.12Å; Y562-K599 HydrophobicContact CD2-CG 3.85Å; Y562-K599 HydrophobicContact CE2-CD 3.81Å; Y562-K599 HydrophobicContact CE2-CG 3.82Å; E592-K599 HydrophobicContact CB-CB 4.31Å; E592-K599 PolarHBondContact N-O 3.49Å; E592-K599 PolarHBondContact O-N 2.87Å; E592-K599 IonicContact OE1-NZ 3.2Å; E592-K599 WeakPolarHBondContact OE2-CD 3.28Å; E592-K599 IonicContact OE2-NZ 3.21Å; E592-K599 PolarHBondContact OE2-NZ 3.3Å; K599-I601 HydrophobicContact CG-CG1 4.39Å
600	V	96	Very high	89.6	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.1	179.9	174.1	0	0	0	0	109.1	I547 I558 K560 V561 Y562 L589 G590 I591	I547-V600 HydrophobicContact CD1-CG1 3.9Å; I558-V600 HydrophobicContact CG2-CB 4.44Å; I558-V600 HydrophobicContact CG2-CG2 3.77Å; K560-V600 PolarHBondContact O-N 3.41Å; V561-V600 CarbonylContact C-O 3.54Å; V561-V600 WeakPolarHBondContact CA-O 3.3Å; V561-V600 HydrophobicContact CG1-CB 4.31Å; V561-V600 HydrophobicContact CG1-CG1 4.16Å; V561-V600 HydrophobicContact CG2-CB 4.25Å; Y562-V600 PolarHBondContact N-O 2.8Å; L589-V600 HydrophobicContact CD1-CG1 3.7Å; G590-V600 CarbonylContact O-C 3.53Å; G590-V600 WeakPolarHBondContact O-CA 3.4Å; I591-V600 HydrophobicContact CG1-CG2 4.4Å
601	I	96.5	Very high	89.3	Confident	20 Å²	20	59.9 Å²	59.9	10%	0.103	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	119.6	176	-51.2	177.1	0	0	0	108.4	Y562 K564 L570 G590 K599	Y562-I601 CarbonylContact O-C 3.51Å; Y562-I601 WeakPolarHBondContact O-CA 3.4Å; K564-I601 HydrophobicContact CB-CG2 4.03Å; L570-I601 HydrophobicContact CD1-CG2 3.94Å; G590-I601 PolarHBondContact N-O 3.03Å; G590-I601 PolarHBondContact O-N 3.03Å; K599-I601 HydrophobicContact CG-CG1 4.39Å
602	L	96.9	Very high	89	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	110.3	169.7	-67.8	172.9	0	0	0	108.7	V522 L543 Y562 K563 K564 F587 L589	V522-L602 HydrophobicContact CG1-CD2 4.17Å; V522-L602 HydrophobicContact CG2-CD2 4.45Å; L543-L602 HydrophobicContact CD1-CD1 4.19Å; L543-L602 HydrophobicContact CD2-CD1 3.85Å; Y562-L602 PolarHBondContact O-N 3.01Å; K563-L602 CarbonylContact C-O 3.5Å; K563-L602 WeakPolarHBondContact CA-O 3.39Å; K564-L602 PolarHBondContact N-O 3.03Å; F587-L602 HydrophobicContact CB-CB 4.15Å; F587-L602 HydrophobicContact CB-CD2 3.9Å; F587-L602 HydrophobicContact CD1-CB 3.95Å; F587-L602 HydrophobicContact CG-CB 4.08Å; F587-L602 HydrophobicContact CG-CD2 4.34Å; L589-L602 HydrophobicContact CB-CD2 4.49Å; L589-L602 HydrophobicContact CD1-CD2 3.8Å
603	T	96.7	Very high	88.7	Confident	41 Å²	41	57.4 Å²	57.4	25%	0.252	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.1	178.1	-54.2	0	0	0	0	109.9	K564 F587 I588	K564-T603 HydrophobicContact CB-CG2 4.16Å; K564-T603 HydrophobicContact CD-CG2 4.02Å; K564-T603 HydrophobicContact CG-CG2 4.23Å; K564-T603 WeakPolarHBondContact O-CA 3.3Å; F587-T603 CarbonylContact C-O 3.57Å; F587-T603 VanDerWaalsContact CA-O 3.26Å; F587-T603 WeakPolarHBondContact CA-O 3.3Å; I588-T603 PolarHBondContact N-O 2.7Å; I588-T603 PolarHBondContact O-N 2.73Å
604	E	93.1	Very high	88.8	Confident	64 Å²	64	54.8 Å²	54.8	30%	0.299	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.3	-179.9	-166.7	179.3	164.8	0	0	110.9	K563 K564 K566 F587	K563-E604 WeakPolarHBondContact CE-OE2 3.42Å; K563-E604 IonicContact NZ-OE2 2.76Å; K563-E604 PolarHBondContact NZ-OE2 2.78Å; K564-E604 PolarHBondContact O-N 3.3Å; K566-E604 HydrophobicContact CG-CB 4.29Å; K566-E604 HydrophobicContact CG-CG 4.19Å; F587-E604 HydrophobicContact CD1-CB 4.31Å; F587-E604 HydrophobicContact CE1-CB 4.13Å; F587-E604 HydrophobicContact CE1-CG 4.23Å
605	I	86	Confident	89.7	Confident	93 Å²	93	52 Å²	52	48%	0.477	30%	0.301	S	S	.	.			trans	-98.7	0	-178.9	-51.4	175.4	0	0	0	110.1	F530 K566 I588	F530-I605 HydrophobicContact CE1-CD1 3.81Å; F530-I605 HydrophobicContact CZ-CD1 3.84Å; K566-I605 WeakPolarHBondContact CE-O 3.28Å; K566-I605 VanDerWaalsContact CE-OXT 3.27Å; K566-I605 WeakPolarHBondContact CE-OXT 3.02Å; K566-I605 PolarHBondContact NZ-O 3.21Å; K566-I605 PolarHBondContact NZ-OXT 2.92Å; I588-I605 HydrophobicContact CD1-CD1 3.43Å; I588-I605 VanDerWaalsContact CD1-CD1 3.43Å; I588-I605 HydrophobicContact CD1-CG1 4.18Å; I588-I605 HydrophobicContact CG1-CD1 3.64Å; I588-I605 HydrophobicContact CG1-CG1 3.81Å

Retrieved 605 of 605 residues in 1109.4 ms (Link to these results)

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